ID: 43786
SMILES:c1(OCCCC)cc2c(cc1CCCCC)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -15.721
InChIKey:YJFYHCVKFKNWJI-UHFFFAOYSA-N
ID: 43787
SMILES:C1C(C)=CC(c2c(O)c(-c3ccc(C)cc3)c(CO)cc2O)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -13.421
InChIKey:XTUPZMWGMVNTRY-UHFFFAOYSA-N
ID: 43788
SMILES:O1CC12C1c3c(cc(CCCCC)cc3OC)OC1C(O)(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.405
InChIKey:ZPDMTZBUZDXECP-UHFFFAOYSA-N
ID: 43789
SMILES:C1(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 43790
SMILES:CC1=CCCC2CC(O)(c3c(O)cc(CCCCC)cc3O)C21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:VLJLGEYLTBOXFR-UHFFFAOYSA-N
ID: 43791
SMILES:C(C)(CCCC)c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c2c1OC13C(C(C)(C)OC2=CC(C)CC3)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.754
CB1 binding score: -15.404
InChIKey:DPIOEPYZAGJTGR-UHFFFAOYSA-N
ID: 43792
SMILES:C12C=C(C)CCC1C(C)(CO)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.929
InChIKey:LFCCHDWTOMXCKF-UHFFFAOYSA-N
ID: 43793
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(O)(C)C)CCC(C)(C2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.545
InChIKey:LRYSPWXTCHNYMD-UHFFFAOYSA-N
ID: 43794
SMILES:c12c(CCCCC)cc(O)c3c1C1C(C(C)(C)O2)CC2C(C)(CCCC1(C)C)C2=C(C(C)C)C(=O)C3=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -16.493
InChIKey:OZUJRLPBJPTTKO-UHFFFAOYSA-N
ID: 43795
SMILES:c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 43796
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 43797
SMILES:CC1C2Cc3c(O)c(C(=O)OC)c(CCCCC)cc3OC2(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -12.872
InChIKey:NYCDJOMFOKUVDP-UHFFFAOYSA-N
ID: 43798
SMILES:C1(=C)CCC(C)C2(C)C(C1)c1c(cc(CCCCC)cc1O)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.241
InChIKey:WPDNZQHDHSSVCX-UHFFFAOYSA-N
ID: 43799
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.792
InChIKey:IEOYHNWUNCMPAY-UHFFFAOYSA-N
ID: 43800
SMILES:c12c(c(CO)c(C3C=C(C)CC(c4cc(CCN(C)C)ccc4OC)C(C(C)=C)C3)cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 597.884
CB1 binding score: -14.912
InChIKey:ZCSPIIKSZRZQLE-UHFFFAOYSA-N
ID: 43801
SMILES:C(CCc1cc(O)c(C2C=C(C=O)CCC2C(C)C)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.562
InChIKey:VGLMBXCWEFWINX-UHFFFAOYSA-N
ID: 43802
SMILES:C(CC(=C)C(=O)C=CC(C)(C)O)CC(C)=CCc1cc(O)c(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.788
InChIKey:XZKHSLXBTBNRBC-UHFFFAOYSA-N
ID: 43803
SMILES:c1(C)c(OC(=O)C)c(CCCC=C)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.787
InChIKey:LTUCJAJLFHUWMG-UHFFFAOYSA-N
ID: 43804
SMILES:C(=CCOc1cc(CCCCC)cc(O)c1)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.314
InChIKey:BIQPDOIGNXBVNT-UHFFFAOYSA-N
ID: 43805
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 43806
SMILES:C(C)(CCCC)c1cc(O)c(C2CC(C(C)=C)CC2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.033
InChIKey:GSPDVUKDAZNCCU-UHFFFAOYSA-N