COc1ccc(C[C@@H]2COC(=O)[C@H]2Cc2ccc3c(c2)OCO3)cc1OC ZINC000001645468 41/42/91/219414291 LEVKKQBBEVGIKN-CVEARBPZSA-N 0 370.401 FG 3.007 0 Anodyne ref FGAARN COc1ccc(C[C@@H]2COC(=O)[C@H]2Cc2ccc3c(c2)OCO3)cc1OC in-vitro biogenic c1cc2c(cc1[C@H]1OC[C@@H]3[C@@H](c4ccc5c(c4)OCO5)OC[C@H]13)OCO2 ZINC000001668768 36/56/65/210365665 PEYUIKBAABKQKQ-AFHBHXEDSA-N 0 354.358 FG 3.219 0 Anodyne ref FGAARN c1cc2c(cc1[C@H]1OC[C@@H]3[C@@H](c4ccc5c(c4)OCO5)OC[C@H]13)OCO2 in-man endogenous C=CCC1=C[C@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(OC)CC1=O ZINC000004098815 12/10/35/204121035 YVRYZXAHRGGELT-MZNUGIIHSA-N 0 372.417 FG 3.326 0 Mild ref FGEARN C=CCC1=C[C@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(OC)CC1=O in-vitro biogenic COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O ZINC000004098921 50/78/63/210507863 HGXBRUKMWQGOIE-AFHBHXEDSA-N 0 358.39 FG 3.19 0 Anodyne ref FGAARN COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O in-vitro biogenic COc1cc([C@H]2OC[C@@H]3[C@H](c4ccc(OC)c(OC)c4)OC[C@H]23)ccc1O ZINC000005037520 90/97/26/493909726 CPJKKWDCUOOTEW-YJPXFSGGSA-N 0 372.417 FG 3.493 0 Anodyne ref FGAARN COc1cc([C@H]2OC[C@@H]3[C@H](c4ccc(OC)c(OC)c4)OC[C@H]23)ccc1O in-vitro biogenic COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc3c(c2)OCO3)cc1OC ZINC000006006751 45/01/36/209450136 LEVKKQBBEVGIKN-JKSUJKDBSA-N 0 370.401 FG 3.007 0 Anodyne ref FGAARN COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc3c(c2)OCO3)cc1OC in-vitro biogenic COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N+]1(C)[O-] ZINC000006068288 95/07/08/493950708 NBDQYITZRPEYEM-YXWRBFHGSA-N 0 357.406 FG 3.183 0 Bother ref FGBBRN COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N+]1(C)[O-] in-vitro biogenic COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(OC)c(OC)c4)OC[C@H]23)ccc1O ZINC000012153652 28/84/78/206288478 CPJKKWDCUOOTEW-VUEDXXQZSA-N 0 372.417 FG 3.493 0 Anodyne ref FGAARN COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(OC)c(OC)c4)OC[C@H]23)ccc1O in-vitro biogenic CC1=CC[C@@]2(C)[C@@H]([C@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O ZINC000013432383 06/67/09/220066709 QHFATPQTYSUZTN-GIGYVVOSSA-N -1 374.477 FG 3.432 3 Anodyne high FGAAHM CC1=CC[C@@]2(C)[C@@H]([C@H](OC(=O)c3ccc([O-])cc3)C1)[C@@](O)(C(C)C)C[C@H]2O in-vitro biogenic CC1=CC[C@@]2(C)[C@@H]([C@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O ZINC000013432383 06/67/05/220066705 QHFATPQTYSUZTN-GIGYVVOSSA-N -1 374.477 FG 3.432 0 Anodyne ref FGAARM CC1=CC[C@@]2(C)[C@@H]([C@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O in-vitro biogenic CC(=O)OC(C)(C)[C@H]1Oc2cc3oc(=O)ccc3cc2[C@H]1OC(=O)C(C)C ZINC000013461193 06/84/84/220068484 IAFDNCWNSBMBIV-MSOLQXFVSA-N 0 374.389 FG 3.136 0 Anodyne ref FGAARN CC(=O)OC(C)(C)[C@H]1Oc2cc3oc(=O)ccc3cc2[C@H]1OC(=O)C(C)C in-vitro biogenic CC(=O)OC(C)(C)[C@H]1Oc2cc3oc(=O)ccc3cc2[C@@H]1OC(=O)C(C)C ZINC000013461195 06/90/51/220069051 IAFDNCWNSBMBIV-ROUUACIJSA-N 0 374.389 FG 3.136 0 Anodyne ref FGAARN CC(=O)OC(C)(C)[C@H]1Oc2cc3oc(=O)ccc3cc2[C@@H]1OC(=O)C(C)C in-vitro biogenic CC(=O)OC(C)(C)[C@@H]1Oc2cc3oc(=O)ccc3cc2[C@H]1OC(=O)C(C)C ZINC000013461197 06/88/52/220068852 IAFDNCWNSBMBIV-QZTJIDSGSA-N 0 374.389 FG 3.136 0 Anodyne ref FGAARN CC(=O)OC(C)(C)[C@@H]1Oc2cc3oc(=O)ccc3cc2[C@H]1OC(=O)C(C)C in-vitro biogenic CC(=O)OC(C)(C)[C@@H]1Oc2cc3oc(=O)ccc3cc2[C@@H]1OC(=O)C(C)C ZINC000013461199 57/94/51/209579451 IAFDNCWNSBMBIV-ZWKOTPCHSA-N 0 374.389 FG 3.136 0 Anodyne ref FGAARN CC(=O)OC(C)(C)[C@@H]1Oc2cc3oc(=O)ccc3cc2[C@@H]1OC(=O)C(C)C in-vitro biogenic CC(C)=CCOc1cc(O)c2c(c1)O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O ZINC000014728270 13/07/29/220130729 CITFYDYEWQIEPX-VQTJNVASSA-N -1 356.374 FG 3.12 3 Anodyne high FGAAHM CC(C)=CCOc1cc([O-])c2c(c1)O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O in-vitro biogenic CC(C)=CCOc1cc(O)c2c(c1)O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O ZINC000014728270 13/07/25/220130725 CITFYDYEWQIEPX-VQTJNVASSA-N 0 356.374 FG 3.12 0 Anodyne ref FGAARN CC(C)=CCOc1cc(O)c2c(c1)O[C@H](c1ccc(O)cc1)[C@@H](O)C2=O in-vitro biogenic COc1ccc(C[C@@H]2COC(=O)[C@@H]2Cc2ccc3c(c2)OCO3)cc1OC ZINC000014760235 13/24/27/220132427 LEVKKQBBEVGIKN-HZPDHXFCSA-N 0 370.401 FG 3.007 0 Anodyne ref FGAARN COc1ccc(C[C@@H]2COC(=O)[C@@H]2Cc2ccc3c(c2)OCO3)cc1OC in-vitro biogenic COc1ccc(C[C@H]2COC(=O)[C@H]2Cc2ccc3c(c2)OCO3)cc1OC ZINC000014760237 32/50/73/494325073 LEVKKQBBEVGIKN-HOTGVXAUSA-N 0 370.401 FG 3.007 0 Anodyne ref FGAARN COc1ccc(C[C@H]2COC(=O)[C@H]2Cc2ccc3c(c2)OCO3)cc1OC in-vitro biogenic COc1c(O)ccc2c(=O)c3c(O)cc4c(c3n(C)c12)C=CC(C)(C)O4 ZINC000014927070 13/60/77/220136077 DIDVBISMWJGFOF-UHFFFAOYSA-N -1 353.374 FG 3.296 3 Bother high FGBEHM COc1c([O-])ccc2c(=O)c3c(O)cc4c(c3n(C)c12)C=CC(C)(C)O4 in-man endogenous COc1c(O)ccc2c(=O)c3c(O)cc4c(c3n(C)c12)C=CC(C)(C)O4 ZINC000014927070 13/60/74/220136074 DIDVBISMWJGFOF-UHFFFAOYSA-N 0 353.374 FG 3.296 0 Bother ref FGBERN COc1c(O)ccc2c(=O)c3c(O)cc4c(c3n(C)c12)C=CC(C)(C)O4 in-man endogenous CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@H](OC(=O)c2ccc(O)cc2)C1 ZINC000014956844 70/00/43/290700043 QHFATPQTYSUZTN-XZAAFUHCSA-N -1 374.477 FG 3.432 3 Anodyne high FGAAHM CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@H](OC(=O)c2ccc([O-])cc2)C1 in-vitro biogenic CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@H](OC(=O)c2ccc(O)cc2)C1 ZINC000014956844 70/00/36/290700036 QHFATPQTYSUZTN-XZAAFUHCSA-N 0 374.477 FG 3.432 0 Anodyne ref FGAARN CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@H](OC(=O)c2ccc(O)cc2)C1 in-vitro biogenic C=C[C@]1(C)C[C@](O)([C@@H]2OC2(C)C)Oc2c1c(=O)oc1cccc(CC)c21 ZINC000015204723 14/97/56/220149756 CLSJUQWISAXGNX-HMXCVIKNSA-N 0 356.418 FG 3.448 0 Mild ref FGEARN C=C[C@]1(C)C[C@](O)([C@@H]2OC2(C)C)Oc2c1c(=O)oc1cccc(CC)c21 in-vitro biogenic COc1c(OC/C=C(\C)C[C@H]2C=C(C)C(=O)O2)ccc2ccc(=O)oc12 ZINC000015212279 14/93/29/220149329 QUKDLMFYXITHBM-JQVXPOPVSA-N 0 356.374 FG 3.389 0 Anodyne ref FGAARN COc1c(OC/C=C(\C)C[C@H]2C=C(C)C(=O)O2)ccc2ccc(=O)oc12 in-vitro biogenic COc1c(OC/C=C(\C)C[C@@H]2C=C(C)C(=O)O2)ccc2ccc(=O)oc12 ZINC000015212281 31/37/86/206313786 QUKDLMFYXITHBM-INDWDQIESA-N 0 356.374 FG 3.389 0 Anodyne ref FGAARN COc1c(OC/C=C(\C)C[C@@H]2C=C(C)C(=O)O2)ccc2ccc(=O)oc12 in-vitro biogenic c1cc2c(cc1[C@H]1OC[C@@H]3[C@H](c4ccc5c(c4)OCO5)OC[C@H]13)OCO2 ZINC000018037965 42/19/93/494421993 PEYUIKBAABKQKQ-WZBLMQSHSA-N 0 354.358 FG 3.219 0 Anodyne ref FGAARN c1cc2c(cc1[C@H]1OC[C@@H]3[C@H](c4ccc5c(c4)OCO5)OC[C@H]13)OCO2 in-man endogenous COc1cc2c(cc1OC)[C@H]1Cc3ccc(OC)c(OC)c3CN1CC2 ZINC000019535046 26/79/44/220267944 AEQDJSLRWYMAQI-QGZVFWFLSA-N 0 355.434 FG 3.377 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@H]1Cc3ccc(OC)c(OC)c3CN1CC2 in-vitro biogenic COc1cc2c(cc1OC)[C@@H]1Cc3ccc(OC)c(OC)c3CN1CC2 ZINC000019535049 26/89/43/220268943 AEQDJSLRWYMAQI-KRWDZBQOSA-N 0 355.434 FG 3.377 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@@H]1Cc3ccc(OC)c(OC)c3CN1CC2 investigational biogenic COC(=O)[C@@]1(O)C=CC[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@H]3CC[C@]21C ZINC000028537346 39/03/04/263390304 WWNYZTBMVRRLJM-GOLBOHCDSA-N 0 374.433 FG 3.17 0 Anodyne ref FGAARN COC(=O)[C@@]1(O)C=CC[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@H]3CC[C@]21C in-vitro biogenic C=C(C)[C@H](O)Cc1c(OC)cc(CCc2ccccc2)c(C(=O)O)c1O ZINC000031161906 06/50/64/291065064 BNAJQKIJVGVGFU-QGZVFWFLSA-N -1 356.418 FG 3.364 0 Mild ref FGEARM C=C(C)[C@H](O)Cc1c(OC)cc(CCc2ccccc2)c(C(=O)[O-])c1O in-vitro biogenic C=C(C)[C@@H](O)Cc1c(OC)cc(CCc2ccccc2)c(C(=O)O)c1O ZINC000031161909 06/50/77/291065077 BNAJQKIJVGVGFU-KRWDZBQOSA-N -1 356.418 FG 3.364 0 Mild ref FGEARM C=C(C)[C@@H](O)Cc1c(OC)cc(CCc2ccccc2)c(C(=O)[O-])c1O in-vitro biogenic COc1cc(CCc2ccccc2)c(C(=O)O)c2c1C[C@H](C(C)(C)O)O2 ZINC000031161960 92/88/05/493928805 XJKIBJFVLHQLKC-QGZVFWFLSA-N -1 356.418 FG 3.253 0 Anodyne ref FGAARM COc1cc(CCc2ccccc2)c(C(=O)[O-])c2c1C[C@H](C(C)(C)O)O2 in-vitro biogenic COc1cc(CCc2ccccc2)c(C(=O)O)c2c1C[C@@H](C(C)(C)O)O2 ZINC000031161964 92/93/44/493929344 XJKIBJFVLHQLKC-KRWDZBQOSA-N -1 356.418 FG 3.253 0 Anodyne ref FGAARM COc1cc(CCc2ccccc2)c(C(=O)[O-])c2c1C[C@@H](C(C)(C)O)O2 in-vitro biogenic COc1cc2c(cc1OC)[C@@H]1Oc3c(cc(OC)c(OC)c3OC)[C@@H]1CO2 ZINC000031164155 84/51/59/209845159 VNXYHRRGEDIKJZ-SJCJKPOMSA-N 0 374.389 FG 3.339 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@@H]1Oc3c(cc(OC)c(OC)c3OC)[C@@H]1CO2 in-vitro biogenic COc1cc2c(cc1OC)[C@@H]1Oc3c(cc(OC)c(OC)c3OC)[C@H]1CO2 ZINC000031164159 92/91/25/493929125 VNXYHRRGEDIKJZ-PXAZEXFGSA-N 0 374.389 FG 3.339 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@@H]1Oc3c(cc(OC)c(OC)c3OC)[C@H]1CO2 in-vitro biogenic COc1cc2c(cc1OC)[C@H]1Oc3c(cc(OC)c(OC)c3OC)[C@@H]1CO2 ZINC000031164163 50/71/22/206507122 VNXYHRRGEDIKJZ-YVEFUNNKSA-N 0 374.389 FG 3.339 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@H]1Oc3c(cc(OC)c(OC)c3OC)[C@@H]1CO2 in-vitro biogenic COc1cc2c(cc1OC)[C@H]1Oc3c(cc(OC)c(OC)c3OC)[C@H]1CO2 ZINC000031164167 92/91/74/493929174 VNXYHRRGEDIKJZ-SJKOYZFVSA-N 0 374.389 FG 3.339 0 Anodyne ref FGAARN COc1cc2c(cc1OC)[C@H]1Oc3c(cc(OC)c(OC)c3OC)[C@H]1CO2 in-vitro biogenic C=CCC1=C[C@]2(OC)[C@H](C)[C@@H](c3ccc(O)c(OC)c3)O[C@]2(OC)CC1=O ZINC000031168604 39/10/63/263391063 ZJCOLWRTVHBIBE-MZNUGIIHSA-N 0 374.433 FG 3.311 0 Mild ref FGEBRN C=CCC1=C[C@]2(OC)[C@H](C)[C@@H](c3ccc(O)c(OC)c3)O[C@]2(OC)CC1=O in-vitro biogenic Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@@H]1C2 ZINC000035270841 07/33/61/291073361 PWDHWBVDFPMFBE-NHQKPONWSA-N 0 360.45 FG 3.034 0 Anodyne ref FGAARN Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@@H]1C2 in-vitro biogenic C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)[C@H]12 ZINC000035458478 18/14/09/207181409 ZMZWVJLMOBCSEP-QRMXYISGSA-N 0 360.45 FG 3.091 0 Anodyne ref FGAARN C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]2(C)CCCC(C)(C)[C@H]12 in-vitro biogenic C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@@]2(O)[C@@]2(C)CCCC(C)(C)[C@H]12 ZINC000035458482 12/60/87/208126087 ZMZWVJLMOBCSEP-CDAGCKDISA-N 0 360.45 FG 3.091 0 Anodyne ref FGABRN C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@@]2(O)[C@@]2(C)CCCC(C)(C)[C@H]12 in-vitro biogenic COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@@H]2C)ccc1O ZINC000036378858 84/83/54/210848354 DGYASNDHNSXGSL-ZRUKYZTQSA-N 0 360.406 FG 3.315 0 Anodyne ref FGAARN COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@@H]2C)ccc1O in-vitro biogenic COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@H]2C)ccc1O ZINC000036378859 08/98/73/494089873 DGYASNDHNSXGSL-LGIAIMSESA-N 0 360.406 FG 3.315 0 Anodyne ref FGAARN COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@H]2C)ccc1O in-vitro biogenic COc1cc([C@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@@H]2C)ccc1O ZINC000036378860 08/99/91/494089991 DGYASNDHNSXGSL-BSWYJSDQSA-N 0 360.406 FG 3.315 0 Anodyne ref FGABRN COc1cc([C@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@@H]2C)ccc1O in-vitro biogenic COc1cc([C@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@H]2C)ccc1O ZINC000036378861 09/02/83/494090283 DGYASNDHNSXGSL-SGMNNIIASA-N 0 360.406 FG 3.315 0 Anodyne ref FGABRN COc1cc([C@H]2O[C@H](c3ccc(O)c(OC)c3)[C@@](C)(O)[C@H]2C)ccc1O in-vitro biogenic COc1ccc(-c2oc3cc4c(c(OC)c3c(=O)c2OC)OCO4)cc1 ZINC000049181202 02/07/96/221020796 LWUQVHKGVXRUPD-UHFFFAOYSA-N 0 356.33 FG 3.215 0 Anodyne ref FGAARN COc1ccc(-c2oc3cc4c(c(OC)c3c(=O)c2OC)OCO4)cc1 in-vitro biogenic COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(OC)c2)c(OC)c1 ZINC000096111375 07/06/71/291070671 DQQXVSVJAJUHOB-UHFFFAOYSA-N -1 360.362 FG 3.247 0 Anodyne ref FGABRM COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)[O-])c(OC)c2)c(OC)c1 in-vitro biogenic C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)[C@@H](CO)N(C)C1=O ZINC000100067438 23/45/89/222234589 YHKYFYCSTJGMID-JWROMMBDSA-N -1 373.493 FG 3.021 1 Mild mid FGEAMM C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C([O-])=C1C(=O)[C@@H](CO)N(C)C1=O in-vitro biogenic C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)[C@@H](CO)N(C)C1=O ZINC000100067438 23/45/86/222234586 YHKYFYCSTJGMID-JWROMMBDSA-N -1 373.493 FG 3.021 1 Mild mid FGEAMM C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C([O-])[C@@H](CO)N(C)C1=O in-vitro biogenic C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)[C@@H](CO)N(C)C1=O ZINC000100067438 23/45/82/222234582 YHKYFYCSTJGMID-JWROMMBDSA-N 0 373.493 FG 3.021 0 Mild ref FGEARN C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1C(=O)[C@@H](CO)N(C)C1=O in-vitro biogenic O=C1Nc2ccccc2-c2nc3ccccc3c(=O)n2-c2c(O)cccc21 ZINC000100268287 24/08/01/222240801 NUBAAWQBTGSVGH-UHFFFAOYSA-N 0 355.353 FG 3.324 1 Anodyne mid FGAAMN O=C1Nc2ccccc2-c2nc3ccccc3c(=O)n2-c2c(O)cccc21 in-vitro biogenic O=C1Nc2ccccc2-c2nc3ccccc3c(=O)n2-c2c(O)cccc21 ZINC000100268287 24/07/95/222240795 NUBAAWQBTGSVGH-UHFFFAOYSA-N -1 355.353 FG 3.324 0 Anodyne ref FGAARM O=C1Nc2ccccc2-c2nc3ccccc3c(=O)n2-c2c([O-])cccc21 in-vitro biogenic COc1cc(CCc2ccccc2)c(C(=O)O)c2c1C[C@@H](O)C(C)(C)O2 ZINC000138700005 46/65/54/495466554 CXFZCZSMQFGFHC-QGZVFWFLSA-N -1 356.418 FG 3.253 0 Anodyne ref FGAARM COc1cc(CCc2ccccc2)c(C(=O)[O-])c2c1C[C@@H](O)C(C)(C)O2 in-vitro biogenic COc1cc(CCc2ccccc2)c(C(=O)O)c2c1C[C@H](O)C(C)(C)O2 ZINC000138700111 46/60/53/495466053 CXFZCZSMQFGFHC-KRWDZBQOSA-N -1 356.418 FG 3.253 0 Anodyne ref FGAARM COc1cc(CCc2ccccc2)c(C(=O)[O-])c2c1C[C@H](O)C(C)(C)O2 in-vitro biogenic C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@@]1(O)c2cc4c(cc2O[C@@H]31)OCO4 ZINC000225453190 64/52/71/518645271 QAECYLYDFBBCCO-SZFUDVHCSA-N 0 366.369 FG 3.009 0 Mild ref FGEARN C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@@]1(O)c2cc4c(cc2O[C@@H]31)OCO4 in-vitro biogenic C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@@]1(O)c2cc4c(cc2O[C@H]31)OCO4 ZINC000225453258 64/47/80/518644780 QAECYLYDFBBCCO-LVXYXVKQSA-N 0 366.369 FG 3.009 0 Mild ref FGEARN C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@@]1(O)c2cc4c(cc2O[C@H]31)OCO4 in-vitro biogenic COc1cc(CCC(=O)CCCCc2ccc(O)c(O)c2)cc(O)c1O ZINC000225461658 06/43/12/497064312 VROIYIJLFIRSJU-UHFFFAOYSA-N 0 360.406 FG 3.432 0 Clean ref FGCARN COc1cc(CCC(=O)CCCCc2ccc(O)c(O)c2)cc(O)c1O in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@@]3(C)[C@@H]1C2 ZINC000230140972 10/29/87/497102987 UHNRJNAOOCIDDJ-KWSMFNEFSA-N 0 360.45 FG 3.164 0 Mild ref FGEARN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@@]3(C)[C@@H]1C2 in-vitro biogenic C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@]1(O)c2cc4c(cc2O[C@@H]31)OCO4 ZINC000230149016 10/29/71/497102971 QAECYLYDFBBCCO-WVFSVQOHSA-N 0 366.369 FG 3.009 0 Mild ref FGEARN C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@]1(O)c2cc4c(cc2O[C@@H]31)OCO4 in-vitro biogenic CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@@H](OC(=O)c2ccc(O)cc2)C1 ZINC000252516141 30/96/45/497309645 QHFATPQTYSUZTN-KAHCOFSNSA-N -1 374.477 FG 3.432 3 Anodyne high FGABHM CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@@H](OC(=O)c2ccc([O-])cc2)C1 in-vitro biogenic CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@@H](OC(=O)c2ccc(O)cc2)C1 ZINC000252516141 30/96/41/497309641 QHFATPQTYSUZTN-KAHCOFSNSA-N 0 374.477 FG 3.432 0 Anodyne ref FGABRN CC1=CC[C@]2(C)[C@H](O)C[C@](O)(C(C)C)[C@H]2[C@@H](OC(=O)c2ccc(O)cc2)C1 in-vitro biogenic CC1=CC[C@@]2(C)[C@@H]([C@@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O ZINC000252516142 21/34/00/210213400 QHFATPQTYSUZTN-UWRIJYQHSA-N 0 374.477 FG 3.432 0 Anodyne ref FGABRN CC1=CC[C@@]2(C)[C@@H]([C@@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O in-vitro biogenic CC1=CC[C@@]2(C)[C@@H]([C@@H](OC(=O)c3ccc(O)cc3)C1)[C@@](O)(C(C)C)C[C@H]2O ZINC000252516142 21/34/07/210213407 QHFATPQTYSUZTN-UWRIJYQHSA-N -1 374.477 FG 3.432 3 Anodyne high FGABHM CC1=CC[C@@]2(C)[C@@H]([C@@H](OC(=O)c3ccc([O-])cc3)C1)[C@@](O)(C(C)C)C[C@H]2O in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@]3(C)[C@H]1C2 ZINC000252516562 20/97/76/526209776 UHNRJNAOOCIDDJ-CNGZUBJHSA-N 0 360.45 FG 3.164 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@]3(C)[C@H]1C2 in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@]3(C)[C@@H]1C2 ZINC000252516563 20/98/59/526209859 UHNRJNAOOCIDDJ-CYVRZMQGSA-N 0 360.45 FG 3.164 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@]3(C)[C@@H]1C2 in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@@]3(C)[C@H]1C2 ZINC000252516564 21/01/68/526210168 UHNRJNAOOCIDDJ-ICEGZTQRSA-N 0 360.45 FG 3.164 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@@H]4O[C@@H]4C(=O)[C@@]3(C)[C@H]1C2 in-vitro biogenic C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@]1(O)c2cc4c(cc2O[C@H]31)OCO4 ZINC000253370372 64/55/79/518645579 QAECYLYDFBBCCO-DLPLYFIVSA-N 0 366.369 FG 3.009 0 Mild ref FGEBRN C=C(C)[C@@H]1Cc2cc3c(cc2O1)OC[C@]1(O)c2cc4c(cc2O[C@H]31)OCO4 in-vitro biogenic COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@](C)(O)[C@H]2C)ccc1O ZINC000253389063 93/25/57/522932557 DGYASNDHNSXGSL-TVCLZNPSSA-N 0 360.406 FG 3.315 0 Anodyne ref FGAERN COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@](C)(O)[C@H]2C)ccc1O COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@](C)(O)[C@@H]2C)ccc1O ZINC000253389064 93/27/11/522932711 DGYASNDHNSXGSL-ZKBAEPOKSA-N 0 360.406 FG 3.315 0 Anodyne ref FGAERN COc1cc([C@@H]2O[C@H](c3ccc(O)c(OC)c3)[C@](C)(O)[C@@H]2C)ccc1O CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)/C(C)=C/[C@@H](C)C(=O)/C=C/[C@@]1(C)O ZINC000253390391 33/05/17/497330517 BIGBTKXKWUHWLH-ARDVQGFVSA-N 0 350.455 FG 3.012 0 Mild ref FGEBRN CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)C(C)=C[C@@H](C)C(=O)C=C[C@@]1(C)O in-vitro biogenic CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)/C(C)=C/[C@@H](C)C(=O)/C=C/[C@]1(C)O ZINC000253390398 33/02/11/497330211 BIGBTKXKWUHWLH-FERDWTOESA-N 0 350.455 FG 3.012 0 Mild ref FGEBRN CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)C(C)=C[C@@H](C)C(=O)C=C[C@]1(C)O in-vitro biogenic CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)/C(C)=C/[C@H](C)C(=O)/C=C/[C@]1(C)O ZINC000253390399 33/02/05/497330205 BIGBTKXKWUHWLH-JRJQZFNCSA-N 0 350.455 FG 3.012 0 Mild ref FGEBRN CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)C(C)=C[C@H](C)C(=O)C=C[C@]1(C)O in-vitro biogenic CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)/C(C)=C/[C@H](C)C(=O)/C=C/[C@@]1(C)O ZINC000253390403 33/00/07/497330007 BIGBTKXKWUHWLH-LBGLDJBASA-N 0 350.455 FG 3.012 0 Mild ref FGEBRN CC[C@@H]1OC(=O)[C@H](C)C[C@H](C)C(=O)C(C)=C[C@H](C)C(=O)C=C[C@@]1(C)O in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@H]1C2 ZINC000253407525 20/96/09/526209609 WNQOWPFARWIGAD-FBGZVIRMSA-N 0 362.466 FG 3.147 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@H]1C2 in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@@H]1C2 ZINC000253407529 20/97/45/526209745 WNQOWPFARWIGAD-JWJAUNBTSA-N 0 362.466 FG 3.147 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@@H]1C2 in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@@H]1C2 ZINC000253407534 21/03/09/526210309 WNQOWPFARWIGAD-PRFYUWOJSA-N 0 362.466 FG 3.147 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@@H]1C2 in-vitro biogenic C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@H]1C2 ZINC000253407540 21/00/69/526210069 WNQOWPFARWIGAD-QGLAHUQNSA-N 0 362.466 FG 3.147 0 Mild ref FGEBRN C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@H]1C2 in-vitro biogenic COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N@@+]1(C)[O-] ZINC000253529710 01/98/29/523019829 NBDQYITZRPEYEM-LHSJRXKWSA-N 0 357.406 FG 3.183 0 Bother ref FGBBRN COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N@@+]1(C)[O-] in-vitro biogenic COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N@+]1(C)[O-] ZINC000253529711 01/95/08/523019508 NBDQYITZRPEYEM-QKKBWIMNSA-N 0 357.406 FG 3.183 0 Bother ref FGBBRN COc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OC)c3-2)CC[N@+]1(C)[O-] in-vitro biogenic COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@@H](O)/C=C\2 ZINC000299826248 07/01/50/291070150 ZTWSXGFXLQEXJQ-IOBAAEILSA-N -1 370.401 FG 3.481 3 Anodyne high FGAAHM COc1c2cc(c(OC)c1[O-])Oc1ccc(cc1)CCC(=O)C[C@@H](O)/C=C\2 in-vitro biogenic COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@@H](O)/C=C\2 ZINC000299826248 07/01/49/291070149 ZTWSXGFXLQEXJQ-IOBAAEILSA-N 0 370.401 FG 3.481 0 Anodyne ref FGAARN COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@@H](O)/C=C\2 in-vitro biogenic Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@@H]1C2 ZINC000514287875 77/34/48/263773448 PWDHWBVDFPMFBE-AZCRCTTESA-N 0 360.45 FG 3.034 0 Anodyne ref FGAARN Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@@H]1C2 in-vitro biogenic Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@H]1C2 ZINC000514287878 77/33/25/263773325 PWDHWBVDFPMFBE-RZHZGLJTSA-N 0 360.45 FG 3.034 0 Anodyne ref FGAARN Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@]3(C)[C@H]1C2 in-vitro biogenic Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@H]1C2 ZINC000514287880 77/34/93/263773493 PWDHWBVDFPMFBE-ZDWMXJANSA-N 0 360.45 FG 3.034 0 Anodyne ref FGAARN Cc1cc(=O)c2c(o1)O[C@]1(C)CC[C@@H]3C(C)(C)[C@H](O)CC(=O)[C@@]3(C)[C@H]1C2 in-vitro biogenic COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@H](O)/C=C\2 ZINC000514288009 03/56/60/560035660 ZTWSXGFXLQEXJQ-QKIRZYONSA-N -1 370.401 FG 3.481 3 Anodyne high FGAAHM COc1c2cc(c(OC)c1[O-])Oc1ccc(cc1)CCC(=O)C[C@H](O)/C=C\2 in-vitro biogenic COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@H](O)/C=C\2 ZINC000514288009 03/56/59/560035659 ZTWSXGFXLQEXJQ-QKIRZYONSA-N 0 370.401 FG 3.481 0 Anodyne ref FGAARN COc1c2cc(c(OC)c1O)Oc1ccc(cc1)CCC(=O)C[C@H](O)/C=C\2 in-vitro biogenic