ID: 125077
SMILES:O(C1CC2C(C3C1(C)Oc1cc(CCCCC)cc(O)c13)C(=O)O2)C(=O)C(CC(C)=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -15.313
InChIKey:NKESYCGHYQSJJS-UHFFFAOYSA-N
ID: 125078
SMILES:CC(O)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 125079
SMILES:C(C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C(=O)O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.801
InChIKey:KTMJEIYRRDXART-UHFFFAOYSA-N
ID: 125080
SMILES:C1(=O)c2ccc3c(c2CCCC1(C)C)Cc1c(O)cc(C)cc1OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -15.653
InChIKey:WQAYHHSPZXOEJA-UHFFFAOYSA-N
ID: 125081
SMILES:C1(CC=C(CCC=C(C)C)C)(C)Oc2c(c(OC)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.75
InChIKey:ZVPJWHXQZGXBKH-UHFFFAOYSA-N
ID: 125082
SMILES:c1(CCCCCC)cc2c(c(O)c1)OC1(C)CCCC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.771
InChIKey:OUZJIUYZOXOXEZ-UHFFFAOYSA-N
ID: 125083
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 125084
SMILES:C(OC)(=O)c1c2c(nc(C)c1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.413
CB1 binding score: -16.261
InChIKey:SSJLZPMPFMLQAD-UHFFFAOYSA-N
ID: 125085
SMILES:c1(OC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.438
InChIKey:RLMNRBUMROHRBN-UHFFFAOYSA-N
ID: 125086
SMILES:C(CCc1c(O)c(C2CC(C)=CCC2C(C)(C)O)c(O)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -10.992
InChIKey:GNYZRXYNTVBVHV-UHFFFAOYSA-N
ID: 125087
SMILES:S(C)(=O)(=O)Cc1cc(O)c(CC2=C(C)CCC(C(C)=C)C2CCC(O)(C#C)C)c(O)c1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.728
CB1 binding score: -13.384
InChIKey:MFLOVMKTFBPJQW-UHFFFAOYSA-N
ID: 125088
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125089
SMILES:C(CCCCC1=C(O)C(=O)C2=C(C1=O)C(O)C1C(C)(O2)CCC1C(C)=C)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.895
CB1 binding score: -15.929
InChIKey:CYHKWOUWHCWFGY-UHFFFAOYSA-N
ID: 125090
SMILES:C1CC(C(C)=C)CCC1(C)OC(=O)CC(C)=CCc1c(O)cc(O)c(C(=O)OC)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -11.799
InChIKey:SVAOHFJJNJNOOF-UHFFFAOYSA-N
ID: 125091
SMILES:O=c1cc(C2C(C(C)C)CCC(C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -13.454
InChIKey:MTYUKVADZPKDIW-UHFFFAOYSA-N
ID: 125092
SMILES:C1(O)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.238
InChIKey:BJYXQJGARPKCEI-UHFFFAOYSA-N
ID: 125093
SMILES:CC(CC1=C(c2c(O)cc(CCCCC)cc2OC)C(O)(C(C)C)CC1)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -15.374
InChIKey:DYRHKVQQQVQLFW-UHFFFAOYSA-N
ID: 125094
SMILES:OC1(C)CC(=O)C(C(C)C)C2c3c(cc(CCCCC)cc3O)OC1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.452
InChIKey:GIGOSRSBUYUABY-UHFFFAOYSA-N
ID: 125095
SMILES:c12c(cc(C)c(Br)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -18.671
InChIKey:RPVWNWGEPFZWQS-UHFFFAOYSA-N
ID: 125096
SMILES:O(C)C(c1cc(CC=C(C)C)c(O)c(C2C=C(C)CCC2C(C)=C)c1O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.397
InChIKey:SABYWDBYIZGTOO-UHFFFAOYSA-N
ID: 125097
SMILES:C1(C(C)(C)O)C(c2c(O)cc(O)cc2C)C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.605
InChIKey:DDTPZSKNSIWIIQ-UHFFFAOYSA-N