ID: 121318
SMILES:c1cc2c(cc1CCCCC)OC(C)(C)C1=C2CC(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.684
InChIKey:VNCKVUXNPPJMKK-UHFFFAOYSA-N
ID: 121319
SMILES:CC(C)c1cc2c3c(c(O)cc2C)C(=O)OC(C)(C)C3C1c1c(O)cc(CC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.521
CB1 binding score: -15.101
InChIKey:MZYBLCSNACDZAD-UHFFFAOYSA-N
ID: 121320
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 121321
SMILES:C(Cc1cc(O)c2c(c1)OC1c3c(O)cc(C)cc3CC1C1C(C)(CCC1C(C)(C)O)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -16.524
InChIKey:DLNHQRKTGNXJJZ-UHFFFAOYSA-N
ID: 121322
SMILES:CC1(C)OC1C(CC1(C)CCc2c(c(O)c(Cc3cc(O)cc(C)c3)cc2O)O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -15.929
InChIKey:WKEPHDDGPSVDRQ-UHFFFAOYSA-N
ID: 121323
SMILES:C1=C(C)CCC(c2c(O)cc(CCC)cc2O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.409
InChIKey:IRQDVKFJBROFOX-UHFFFAOYSA-N
ID: 121324
SMILES:O1C(=O)C(O)C2(C)CC3(c4c(O)cc(CCCCC)cc4OC(O)(C1C(C)=C)OC2=O)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.523
CB1 binding score: -15.16
InChIKey:LQZPJUHHZWXPSB-UHFFFAOYSA-N
ID: 121325
SMILES:c12c3c(C)c(CCCCC)cc1OC(C)(C)C2CCC3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -13.234
InChIKey:UJXNSXNCBGBZIK-UHFFFAOYSA-N
ID: 121326
SMILES:C1CC2(C)C(CCC3(C)Oc4cc(CCCCC)cc(O)c4C32)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.499
InChIKey:UIRGVYQCRUADTF-UHFFFAOYSA-N
ID: 121327
SMILES:O=C(Oc1cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 121328
SMILES:C(c1c2c(cc(CCCCC)c1)OC(C(C)(C)O)CC2)CC(C)(C=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: Not available
InChIKey:JHDBEOIBGJDDQC-UHFFFAOYSA-N
ID: 121329
SMILES:c12c(cc(CCCCC)cc1O)OC1(C(C)CCC(C(C)=C)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.559
InChIKey:BBQPGDCPZRGREM-UHFFFAOYSA-N
ID: 121330
SMILES:C12CC3c4c(O)cc(CCCCC)cc4OC(C)(C)C3CCC1(C)C1C(=O)OCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -11.945
InChIKey:BSMMUIGRUCWNMI-UHFFFAOYSA-N
ID: 121331
SMILES:C1C(C)(C(c2cc(O)c(C)c(OC)c2)C)OC(C)(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -13.537
InChIKey:ICGWMYUFSHVUDO-UHFFFAOYSA-N
ID: 121332
SMILES:C1C(C(C)=C)C(C=C)(C)CC(OC)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.605
InChIKey:MLXRODOEBMKQEJ-UHFFFAOYSA-N
ID: 121333
SMILES:C1C(C(C)=C)C2c3c(cc(CCCCC)cc3O)OC(C)(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 121334
SMILES:C1CC(C)(C)C2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.792
InChIKey:GUQWNUQGCMMKJW-UHFFFAOYSA-N
ID: 121335
SMILES:O(C)c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(OC)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.771
InChIKey:JQQKPZURVIFKCO-UHFFFAOYSA-N
ID: 121336
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 121337
SMILES:c1c(C(C)(C=C)C)c2c(c(O)c1)C(O)C1C(CCC1C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.465
InChIKey:CLMGZSRHFQTPAR-UHFFFAOYSA-N
ID: 121338
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)ccc1C(CC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.049
InChIKey:OECLOSQMABRUKX-UHFFFAOYSA-N