O=c1oc2cc(O)ccc2c2oc3cc(O)ccc3c12 ZINC000000001219 22/85/16/285228516 ZZIALNLLNHEQPJ-UHFFFAOYSA-N 0 268.224 CG 3.104 1 Bother mid CGBAMN O=c1oc2cc(O)ccc2c2oc3cc(O)ccc3c12 in-man endogenous O=c1oc2cc(O)ccc2c2oc3cc(O)ccc3c12 ZINC000000001219 22/85/14/285228514 ZZIALNLLNHEQPJ-UHFFFAOYSA-N -1 268.224 CG 3.104 0 Bother ref CGBARM O=c1oc2cc([O-])ccc2c2oc3cc(O)ccc3c12 in-man endogenous COc1cccc2oc(-c3ccccc3)cc(=O)c12 ZINC000000005954 26/96/94/368269694 XRQSPUXANRGDAV-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1cccc2oc(-c3ccccc3)cc(=O)c12 biogenic in-vivo COc1ccc2c(=O)cc(-c3ccccc3)oc2c1 ZINC000000018056 27/10/64/368271064 QKNDCRMJDZLFEG-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1ccc2c(=O)cc(-c3ccccc3)oc2c1 in-vitro biogenic COc1cccc(-c2cc(=O)c3ccccc3o2)c1OC ZINC000000038937 51/32/02/169513202 OHEGMEUWGGBBHR-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3ccccc3o2)c1OC COc1ccccc1-c1cc(=O)c2cc(O)ccc2o1 ZINC000000038939 27/40/17/368274017 OOGPSPVFDWHSGX-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccccc1-c1cc(=O)c2cc(O)ccc2o1 in-vitro COc1cc(-c2cc(=O)c3ccccc3o2)ccc1O ZINC000000038941 51/33/65/169513365 KTFLFGFPJQSPNR-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cc(-c2cc(=O)c3ccccc3o2)ccc1O COc1ccccc1-c1oc2ccccc2c(=O)c1OC ZINC000000039118 27/55/49/368275549 SJZIKJCJJAPNQI-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccccc1-c1oc2ccccc2c(=O)c1OC Cc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1 ZINC000000039120 51/37/02/169513702 KLGALCMPMFKGDQ-UHFFFAOYSA-N 0 252.269 CG 3.474 0 Anodyne ref CGAARN Cc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1 COc1ccc2oc(-c3ccccc3OC)cc(=O)c2c1 ZINC000000039291 51/37/06/169513706 PJJFYUAXYSKODT-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc2oc(-c3ccccc3OC)cc(=O)c2c1 in-vitro COc1ccc2oc(-c3ccccc3)c(OC)c(=O)c2c1 ZINC000000039295 27/62/86/368276286 BZKORUNDAHVLAO-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc2oc(-c3ccccc3)c(OC)c(=O)c2c1 in-vitro COc1cccc(-c2cc(=O)c3cc(OC)ccc3o2)c1 ZINC000000039296 27/61/09/368276109 LLLIKVGWTVPYAL-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3cc(OC)ccc3o2)c1 in-vitro COc1cc2oc(-c3ccccc3)cc(=O)c2cc1OC ZINC000000039297 51/39/57/169513957 XZRIVAKQBKTLEQ-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cc2oc(-c3ccccc3)cc(=O)c2cc1OC in-vitro COc1ccc(-c2oc3ccccc3c(=O)c2O)cc1OC ZINC000000039299 27/56/33/368275633 BXLAVJWSFYZDPF-UHFFFAOYSA-N 0 298.294 CG 3.183 0 Anodyne ref CGAARN COc1ccc(-c2oc3ccccc3c(=O)c2O)cc1OC in-vitro COc1cccc(-c2oc3ccccc3c(=O)c2O)c1 ZINC000000039300 27/55/10/368275510 GYLGASXCHFNKHD-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cccc(-c2oc3ccccc3c(=O)c2O)c1 COc1cccc(-c2cc(=O)c3cc(O)ccc3o2)c1 ZINC000000039301 27/56/65/368275665 JTOPPXPJVKFGSW-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3cc(O)ccc3o2)c1 COc1ccccc1-c1cc(=O)c2ccc(O)cc2o1 ZINC000000039302 27/55/38/368275538 PFEQKIBOPJQNBI-UHFFFAOYSA-N 0 268.268 CG 3.174 2 Anodyne low CGAALN COc1ccccc1-c1cc(=O)c2ccc(O)cc2o1 COc1ccccc1-c1cc(=O)c2ccc(O)cc2o1 ZINC000000039302 27/55/32/368275532 PFEQKIBOPJQNBI-UHFFFAOYSA-N -1 268.268 CG 3.174 0 Anodyne ref CGAARM COc1ccccc1-c1cc(=O)c2ccc([O-])cc2o1 COc1ccc2c(=O)cc(-c3ccccc3)oc2c1O ZINC000000039303 27/61/41/368276141 YUFKWMXGTOJNRX-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1ccc2c(=O)cc(-c3ccccc3)oc2c1[O-] COc1ccc2c(=O)cc(-c3ccccc3)oc2c1O ZINC000000039303 27/61/37/368276137 YUFKWMXGTOJNRX-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc2c(=O)cc(-c3ccccc3)oc2c1O COc1cc2oc(-c3ccccc3)cc(=O)c2cc1O ZINC000000039308 51/36/61/169513661 AEVRENPSCMLALQ-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cc2oc(-c3ccccc3)cc(=O)c2cc1O COc1ccccc1-c1cc(=O)c2ccccc2o1 ZINC000000039310 27/59/57/368275957 YEHDMSUNJUONMW-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1ccccc1-c1cc(=O)c2ccccc2o1 in-vitro biogenic COc1cccc2oc(-c3ccc(O)cc3)cc(=O)c12 ZINC000000039311 27/61/02/368276102 SOXQLRMCWAKIPS-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1cccc2oc(-c3ccc([O-])cc3)cc(=O)c12 COc1cccc2oc(-c3ccc(O)cc3)cc(=O)c12 ZINC000000039311 27/60/93/368276093 SOXQLRMCWAKIPS-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cccc2oc(-c3ccc(O)cc3)cc(=O)c12 COc1ccc2oc(-c3ccc(O)cc3)cc(=O)c2c1 ZINC000000039312 27/60/17/368276017 IGELAJYEOYKEOS-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1ccc2oc(-c3ccc([O-])cc3)cc(=O)c2c1 in-vitro COc1ccc2oc(-c3ccc(O)cc3)cc(=O)c2c1 ZINC000000039312 27/60/12/368276012 IGELAJYEOYKEOS-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc2oc(-c3ccc(O)cc3)cc(=O)c2c1 in-vitro COc1ccc2c(=O)cc(-c3ccc(O)cc3)oc2c1 ZINC000000039313 27/58/74/368275874 DZUKXCCSULKRJA-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1ccc2c(=O)cc(-c3ccc([O-])cc3)oc2c1 in-vitro biogenic COc1ccc2c(=O)cc(-c3ccc(O)cc3)oc2c1 ZINC000000039313 27/58/65/368275865 DZUKXCCSULKRJA-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc2c(=O)cc(-c3ccc(O)cc3)oc2c1 in-vitro biogenic COc1cccc(-c2cc(=O)c3ccccc3o2)c1 ZINC000000039314 27/55/44/368275544 KIEVPIBIYKKJRJ-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3ccccc3o2)c1 COc1ccc2c(=O)c(-c3ccccc3)coc2c1 ZINC000000046554 27/71/25/368277125 IECSQLKWZBEUGA-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1ccc2c(=O)c(-c3ccccc3)coc2c1 aggregator in-vitro O=C(O)c1ccccc1C(=O)c1ccc(Cl)cc1 ZINC000000056527 27/93/82/368279382 YWECCEXWKFHHQJ-UHFFFAOYSA-N -1 260.676 CG 3.269 0 Anodyne ref CGAARM O=C([O-])c1ccccc1C(=O)c1ccc(Cl)cc1 in-vitro COc1ccc(-c2coc3cc(OC)ccc3c2=O)cc1 ZINC000000057588 52/08/37/169520837 LPNBCGIVZXHHHO-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2coc3cc(OC)ccc3c2=O)cc1 in-vitro biogenic CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1 ZINC000000057595 49/78/40/276497840 OLHOIERZAZMHGK-UHFFFAOYSA-N 0 258.195 CG 3.211 0 Anodyne ref CGAARN CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1 Cc1c(-c2ccccc2)oc2c(C(=O)O)cccc2c1=O ZINC000000057646 90/63/08/391906308 KMMBBZOSQNLLMN-UHFFFAOYSA-N -1 280.279 CG 3.467 0 Anodyne ref CGAARM Cc1c(-c2ccccc2)oc2c(C(=O)[O-])cccc2c1=O in-vitro COc1c(-c2ccccc2)oc2cccc(OC)c2c1=O ZINC000000057660 27/98/54/368279854 MLYYOHQNXPDGGV-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1c(-c2ccccc2)oc2cccc(OC)c2c1=O COc1ccc2c(=O)c(OC)c(-c3ccccc3)oc2c1 ZINC000000057661 27/94/25/368279425 CNDZOPXQZSXGSK-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc2c(=O)c(OC)c(-c3ccccc3)oc2c1 in-vitro COc1cccc(-c2oc3ccccc3c(=O)c2OC)c1 ZINC000000057662 52/06/21/169520621 AUAXNNILRNCQAX-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cccc(-c2oc3ccccc3c(=O)c2OC)c1 COc1ccc(-c2oc3ccccc3c(=O)c2OC)cc1 ZINC000000057663 27/93/52/368279352 AFIUIJXKXMMNCK-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2oc3ccccc3c(=O)c2OC)cc1 in-vitro COc1ccccc1-c1cc(=O)c2c(OC)cccc2o1 ZINC000000057664 27/97/28/368279728 QNKIRTADURZGPG-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccccc1-c1cc(=O)c2c(OC)cccc2o1 in-vitro COc1cccc(-c2cc(=O)c3c(OC)cccc3o2)c1 ZINC000000057665 27/97/81/368279781 HHAYKNGPBZOQMY-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3c(OC)cccc3o2)c1 in-vitro biogenic COc1ccc(-c2cc(=O)c3c(OC)cccc3o2)cc1 ZINC000000057666 27/96/49/368279649 LUCPCQIWHDVLMX-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3c(OC)cccc3o2)cc1 in-vitro COc1ccc(-c2cc(=O)c3cc(OC)ccc3o2)cc1 ZINC000000057667 27/95/70/368279570 ANVFDWBCVDQNEZ-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3cc(OC)ccc3o2)cc1 in-vitro COc1ccc2c(=O)cc(-c3ccccc3OC)oc2c1 ZINC000000057668 27/96/59/368279659 WVWDHKIZBHIGJE-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc2c(=O)cc(-c3ccccc3OC)oc2c1 in-vitro COc1cccc(-c2cc(=O)c3ccc(OC)cc3o2)c1 ZINC000000057669 27/92/84/368279284 GUHXVSRRBMHSSC-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3ccc(OC)cc3o2)c1 in-vitro COc1ccc(-c2cc(=O)c3ccc(OC)cc3o2)cc1 ZINC000000057670 27/99/21/368279921 LGTXUFBDCDFQIU-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3ccc(OC)cc3o2)cc1 in-vitro biogenic COc1ccc(-c2cc(=O)c3ccccc3o2)c(OC)c1 ZINC000000057671 27/94/34/368279434 OUAHROFFUILDCC-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3ccccc3o2)c(OC)c1 in-vitro biogenic COc1ccc(-c2cc(=O)c3ccccc3o2)cc1OC ZINC000000057672 27/93/13/368279313 ZGHORMOOTZTQFL-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3ccccc3o2)cc1OC in-vitro biogenic COc1cccc2oc(-c3ccccc3)c(O)c(=O)c12 ZINC000000057680 34/38/22/295343822 WHLQVYWQNZFUPW-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1cccc2oc(-c3ccccc3)c([O-])c(=O)c12 in-vitro biogenic COc1cccc2oc(-c3ccccc3)c(O)c(=O)c12 ZINC000000057680 34/38/16/295343816 WHLQVYWQNZFUPW-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cccc2oc(-c3ccccc3)c(O)c(=O)c12 in-vitro biogenic COc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1 ZINC000000057681 27/99/90/368279990 OGURJSOPVFCIOO-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc2oc(-c3ccccc3)c(O)c(=O)c2c1 in-vitro biogenic COc1ccc2c(=O)c(O)c(-c3ccccc3)oc2c1 ZINC000000057682 52/07/76/169520776 IPRIGHIBTRMTDP-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc2c(=O)c(O)c(-c3ccccc3)oc2c1 in-vitro biogenic COc1ccc(-c2oc3ccccc3c(=O)c2O)cc1 ZINC000000057683 27/93/75/368279375 IIBBFGMVMNZMGA-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc(-c2oc3ccccc3c(=O)c2O)cc1 COc1ccccc1-c1cc(=O)c2c(O)cccc2o1 ZINC000000057684 27/94/79/368279479 OHYPQURAHPKQEA-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGABHM COc1ccccc1-c1cc(=O)c2c([O-])cccc2o1 COc1ccccc1-c1cc(=O)c2c(O)cccc2o1 ZINC000000057684 27/94/71/368279471 OHYPQURAHPKQEA-UHFFFAOYSA-N -1 268.268 CG 3.174 1 Anodyne mid CGABMM COc1ccccc1-c1cc(=O)c2c(O)cccc2o1 COc1ccccc1-c1cc(=O)c2c(O)cccc2o1 ZINC000000057684 27/94/66/368279466 OHYPQURAHPKQEA-UHFFFAOYSA-N 0 268.268 CG 3.174 1 Anodyne mid CGABMN COc1ccccc1-c1cc([O-])c2c(=O)cccc-2o1 COc1ccccc1-c1cc(=O)c2c(O)cccc2o1 ZINC000000057684 27/94/63/368279463 OHYPQURAHPKQEA-UHFFFAOYSA-N -1 268.268 CG 3.174 0 Anodyne ref CGABRM COc1ccccc1-c1cc(O)c2c(=O)cccc-2o1 COc1cccc(-c2cc(=O)c3c(O)cccc3o2)c1 ZINC000000057685 27/97/52/368279752 IPQOBEBHJDIMQR-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGAAHM COc1cccc(-c2cc(=O)c3c([O-])cccc3o2)c1 COc1cccc(-c2cc(=O)c3c(O)cccc3o2)c1 ZINC000000057685 27/97/49/368279749 IPQOBEBHJDIMQR-UHFFFAOYSA-N -1 268.268 CG 3.174 1 Anodyne mid CGAAMM COc1cccc(-c2cc(=O)c3c(O)cccc3o2)c1 COc1cccc(-c2cc(=O)c3c(O)cccc3o2)c1 ZINC000000057685 27/97/43/368279743 IPQOBEBHJDIMQR-UHFFFAOYSA-N 0 268.268 CG 3.174 1 Anodyne mid CGAAMN COc1cccc(-c2cc([O-])c3c(=O)cccc-3o2)c1 COc1cccc(-c2cc(=O)c3c(O)cccc3o2)c1 ZINC000000057685 27/97/33/368279733 IPQOBEBHJDIMQR-UHFFFAOYSA-N -1 268.268 CG 3.174 0 Anodyne ref CGAARM COc1cccc(-c2cc(O)c3c(=O)cccc-3o2)c1 COc1ccc(-c2cc(=O)c3c(O)cccc3o2)cc1 ZINC000000057686 27/92/58/368279258 WAGFUKCEIMCKQR-UHFFFAOYSA-N -1 268.268 CG 3.174 3 Anodyne high CGABHM COc1ccc(-c2cc(=O)c3c([O-])cccc3o2)cc1 COc1ccc(-c2cc(=O)c3c(O)cccc3o2)cc1 ZINC000000057686 27/92/57/368279257 WAGFUKCEIMCKQR-UHFFFAOYSA-N -1 268.268 CG 3.174 1 Anodyne mid CGABMM COc1ccc(-c2cc(=O)c3c(O)cccc3o2)cc1 COc1ccc(-c2cc(=O)c3c(O)cccc3o2)cc1 ZINC000000057686 27/92/56/368279256 WAGFUKCEIMCKQR-UHFFFAOYSA-N 0 268.268 CG 3.174 1 Anodyne mid CGABMN COc1ccc(-c2cc([O-])c3c(=O)cccc-3o2)cc1 COc1ccc(-c2cc(=O)c3c(O)cccc3o2)cc1 ZINC000000057686 27/92/50/368279250 WAGFUKCEIMCKQR-UHFFFAOYSA-N -1 268.268 CG 3.174 0 Anodyne ref CGABRM COc1ccc(-c2cc(O)c3c(=O)cccc-3o2)cc1 COc1ccc(-c2cc(=O)c3cc(O)ccc3o2)cc1 ZINC000000057687 27/95/35/368279535 RMPRESDCJMOAHW-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3cc(O)ccc3o2)cc1 in-vitro biogenic COc1cccc(-c2cc(=O)c3ccc(O)cc3o2)c1 ZINC000000057688 27/94/05/368279405 PTXIWVJSAQPKEY-UHFFFAOYSA-N 0 268.268 CG 3.174 2 Anodyne low CGAALN COc1cccc(-c2cc(=O)c3ccc(O)cc3o2)c1 COc1cccc(-c2cc(=O)c3ccc(O)cc3o2)c1 ZINC000000057688 27/93/99/368279399 PTXIWVJSAQPKEY-UHFFFAOYSA-N 0 268.268 CG 3.174 0 Anodyne ref CGAARN COc1cccc(-c2cc(=O)c3ccc([O-])cc3o2)c1 COc1ccc(-c2cc(=O)c3ccccc3o2)cc1 ZINC000000057689 52/12/47/169521247 OMICQBVLCVRFGN-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1ccc(-c2cc(=O)c3ccccc3o2)cc1 in-vitro biogenic O=C(O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F ZINC000000057698 27/99/04/304279904 HSZJMDBOSZVDOK-UHFFFAOYSA-N -1 290.628 CG 3.243 0 Anodyne ref CGAARM O=C([O-])c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F O=C(c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1O ZINC000000057705 28/01/18/368280118 HEVRUKPQOSEFKD-UHFFFAOYSA-N 0 298.729 CG 3.462 2 Anodyne low CGAALN O=C(c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1O O=C(c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1O ZINC000000057705 28/01/10/368280110 HEVRUKPQOSEFKD-UHFFFAOYSA-N 0 298.729 CG 3.462 0 Anodyne ref CGAARN O=C(c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1[O-] Cc1ccc(O)c(C(=O)c2cnn(-c3ccccc3)c2)c1 ZINC000000057709 27/99/59/368279959 VYXJMOPDZFQVSZ-UHFFFAOYSA-N -1 278.311 CG 3.117 1 Anodyne mid CGAAMM Cc1ccc([O-])c(C(=O)c2cnn(-c3ccccc3)c2)c1 Cc1ccc(O)c(C(=O)c2cnn(-c3ccccc3)c2)c1 ZINC000000057709 27/99/49/368279949 VYXJMOPDZFQVSZ-UHFFFAOYSA-N -1 278.311 CG 3.117 0 Anodyne ref CGAARM Cc1ccc(O)c(C(=O)c2cnn(-c3ccccc3)c2)c1 COc1cccc(-c2oc3ccccc3c(=O)c2O)c1OC ZINC000000057748 27/96/03/368279603 KEUIFZDBIBQKJD-UHFFFAOYSA-N -1 298.294 CG 3.183 3 Anodyne high CGABHM COc1cccc(-c2oc3ccccc3c(=O)c2[O-])c1OC in-vitro biogenic COc1cccc(-c2oc3ccccc3c(=O)c2O)c1OC ZINC000000057748 27/95/96/368279596 KEUIFZDBIBQKJD-UHFFFAOYSA-N -1 298.294 CG 3.183 0 Anodyne ref CGABRM COc1cccc(-c2oc3ccccc3c(=O)c2O)c1OC in-vitro biogenic COc1ccc(-c2oc3ccccc3c(=O)c2O)c(OC)c1 ZINC000000057749 27/95/06/368279506 NAIAWYFLUAEJDT-UHFFFAOYSA-N -1 298.294 CG 3.183 3 Anodyne high CGAAHM COc1ccc(-c2oc3ccccc3c(=O)c2[O-])c(OC)c1 COc1ccc(-c2oc3ccccc3c(=O)c2O)c(OC)c1 ZINC000000057749 27/94/97/368279497 NAIAWYFLUAEJDT-UHFFFAOYSA-N -1 298.294 CG 3.183 0 Anodyne ref CGAARM COc1ccc(-c2oc3ccccc3c(=O)c2O)c(OC)c1 COc1ccc2oc(-c3ccccc3)cc(=O)c2c1 ZINC000000057751 27/99/96/368279996 XZQLSABETMKIGG-UHFFFAOYSA-N 0 252.269 CG 3.469 0 Anodyne ref CGAARN COc1ccc2oc(-c3ccccc3)cc(=O)c2c1 in-vitro biogenic COc1cccc([C@H]2CC(=O)c3ccccc3O2)c1OC ZINC000000057758 52/12/69/169521269 JQWFJSITMYCDOV-MRXNPFEDSA-N 0 284.311 CG 3.41 0 Anodyne ref CGABRN COc1cccc([C@H]2CC(=O)c3ccccc3O2)c1OC in-vitro biogenic COc1cccc([C@@H]2CC(=O)c3ccccc3O2)c1OC ZINC000000057759 27/93/03/368279303 JQWFJSITMYCDOV-INIZCTEOSA-N 0 284.311 CG 3.41 0 Anodyne ref CGABRN COc1cccc([C@@H]2CC(=O)c3ccccc3O2)c1OC in-vitro biogenic Cc1cc(O)cc2oc(-c3ccccc3)cc(=O)c12 ZINC000000057768 37/09/09/301370909 QGHXBJKZPBTQQL-UHFFFAOYSA-N 0 252.269 CG 3.474 2 Anodyne low CGAALN Cc1cc(O)cc2oc(-c3ccccc3)cc(=O)c12 Cc1cc(O)cc2oc(-c3ccccc3)cc(=O)c12 ZINC000000057768 37/09/01/301370901 QGHXBJKZPBTQQL-UHFFFAOYSA-N -1 252.269 CG 3.474 0 Anodyne ref CGAARM Cc1cc([O-])cc2oc(-c3ccccc3)cc(=O)c12 Cc1c(C#N)c(=O)oc2c(Br)cc(Cl)cc12 ZINC000000057775 20/09/14/280200914 WEEBCFNJANPVHG-UHFFFAOYSA-N 0 298.523 CG 3.389 0 Mild ref CGEARN Cc1c(C#N)c(=O)oc2c(Br)cc(Cl)cc12 Cc1cc2oc(=O)c([N+](=O)[O-])c(Cl)c2cc1Cl ZINC000000057777 90/59/26/391905926 IUKUFEBYXNMGLE-UHFFFAOYSA-N 0 274.059 CG 3.316 0 Bother ref CGBARN Cc1cc2oc(=O)c([N+](=O)[O-])c(Cl)c2cc1Cl Cc1c(C#N)c(=O)oc2c(Cl)cc(Br)cc12 ZINC000000057781 20/09/98/280200998 MXUUEWIHAROHII-UHFFFAOYSA-N 0 298.523 CG 3.389 0 Mild ref CGEARN Cc1c(C#N)c(=O)oc2c(Cl)cc(Br)cc12 COc1ccc(-c2cc3ccccc3oc2=O)cc1OC ZINC000000057802 27/92/28/368279228 OIFPKNYYBNPHRA-UHFFFAOYSA-N 0 282.295 CG 3.477 0 Anodyne ref CGAARN COc1ccc(-c2cc3ccccc3oc2=O)cc1OC COc1ccc(-c2cc3ccc(O)cc3oc2=O)cc1OC ZINC000000057811 27/92/19/368279219 DEMDRGFMSDURSV-UHFFFAOYSA-N 0 298.294 CG 3.183 1 Anodyne mid CGAAMN COc1ccc(-c2cc3ccc(O)cc3oc2=O)cc1OC COc1ccc(-c2cc3ccc(O)cc3oc2=O)cc1OC ZINC000000057811 27/92/15/368279215 DEMDRGFMSDURSV-UHFFFAOYSA-N 0 298.294 CG 3.183 0 Anodyne ref CGAARN COc1ccc(-c2cc3ccc([O-])cc3oc2=O)cc1OC COc1ccc([C@H]2CC(=O)c3ccccc3O2)cc1OC ZINC000000057862 27/97/70/368279770 JFIUXPGYJBPFAW-MRXNPFEDSA-N 0 284.311 CG 3.41 0 Anodyne ref CGAARN COc1ccc([C@H]2CC(=O)c3ccccc3O2)cc1OC in-vitro biogenic COc1ccc([C@@H]2CC(=O)c3ccccc3O2)cc1OC ZINC000000057863 52/10/61/169521061 JFIUXPGYJBPFAW-INIZCTEOSA-N 0 284.311 CG 3.41 0 Anodyne ref CGAARN COc1ccc([C@@H]2CC(=O)c3ccccc3O2)cc1OC in-vitro biogenic COc1ccc(-c2oc3ccc(C)cc3c(=O)c2O)cc1 ZINC000000057869 86/52/28/277865228 XBEINZKGCYZUQJ-UHFFFAOYSA-N 0 282.295 CG 3.483 0 Anodyne ref CGAARN COc1ccc(-c2oc3ccc(C)cc3c(=O)c2O)cc1 COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2O)c1 ZINC000000057882 27/99/73/368279973 WOEUTFRCQAFFOM-UHFFFAOYSA-N -1 298.294 CG 3.183 3 Anodyne high CGAAHM COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2[O-])c1 in-vitro biogenic COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2O)c1 ZINC000000057882 27/99/69/368279969 WOEUTFRCQAFFOM-UHFFFAOYSA-N -1 298.294 CG 3.183 0 Anodyne ref CGAARM COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2O)c1 in-vitro biogenic COc1cccc(-c2oc3cc(OC)ccc3c(=O)c2O)c1 ZINC000000057883 52/13/25/169521325 PFMGWOVPHHEHAL-UHFFFAOYSA-N 0 298.294 CG 3.183 0 Anodyne ref CGAARN COc1cccc(-c2oc3cc(OC)ccc3c(=O)c2O)c1 COc1ccc(-c2oc3cc(OC)ccc3c(=O)c2O)cc1 ZINC000000057890 28/00/64/368280064 IFHXSMSQHPVVSF-UHFFFAOYSA-N 0 298.294 CG 3.183 0 Anodyne ref CGAARN COc1ccc(-c2oc3cc(OC)ccc3c(=O)c2O)cc1 COc1ccc(-c2oc3ccc(OC)cc3c(=O)c2O)cc1 ZINC000000057921 27/92/89/368279289 RIRAMOVDGJDPRU-UHFFFAOYSA-N 0 298.294 CG 3.183 0 Anodyne ref CGAARN COc1ccc(-c2oc3ccc(OC)cc3c(=O)c2O)cc1 COc1ccc2c(c1)O[C@@H](c1ccccc1)CC2=O ZINC000000057952 97/85/72/277978572 VYESEQLQFXUROZ-OAHLLOKOSA-N 0 254.285 CG 3.402 0 Anodyne ref CGAARN COc1ccc2c(c1)O[C@@H](c1ccccc1)CC2=O biogenic in-vivo COc1ccc2c(c1)O[C@H](c1ccccc1)CC2=O ZINC000000057953 97/86/02/277978602 VYESEQLQFXUROZ-HNNXBMFYSA-N 0 254.285 CG 3.402 0 Anodyne ref CGAARN COc1ccc2c(c1)O[C@H](c1ccccc1)CC2=O biogenic in-vivo COc1ccc2c(c1)C(=O)C[C@@H](c1ccccc1)O2 ZINC000000057954 27/95/14/368279514 YURQMHCZHLMHIB-INIZCTEOSA-N 0 254.285 CG 3.402 0 Anodyne ref CGAARN COc1ccc2c(c1)C(=O)C[C@@H](c1ccccc1)O2 in-vitro biogenic COc1ccc2c(c1)C(=O)C[C@H](c1ccccc1)O2 ZINC000000057955 27/98/77/368279877 YURQMHCZHLMHIB-MRXNPFEDSA-N 0 254.285 CG 3.402 0 Anodyne ref CGAARN COc1ccc2c(c1)C(=O)C[C@H](c1ccccc1)O2 in-vitro biogenic