ID: 139420
SMILES:c1(C2C=C(C)CCC2C(C)=C)c(O)cc(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 139421
SMILES:CC(C)=CCC1C(=O)c2cc(CCCCC)cc(O)c2CO1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.811
InChIKey:PRYNGAYHVYVBAG-UHFFFAOYSA-N
ID: 139422
SMILES:O=C1c2c(O)cc(CCCCC)cc2OC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.104
InChIKey:RUSNJCCUCAUYFM-UHFFFAOYSA-N
ID: 139423
SMILES:O1c2c(c(O)cc(Br)c2C(CC2C(C)(C)OC(=O)C2O)(C)C)CCO1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 415.28
CB1 binding score: -15.92
InChIKey:YRWLAZHJGDPLQP-UHFFFAOYSA-N
ID: 139424
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 139425
SMILES:c1(O)c(O)cc(CC=C(C)CCC=C(C)C)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.919
InChIKey:OGSJHFLBRBTMQE-UHFFFAOYSA-N
ID: 139426
SMILES:COC1C(C(=O)O)CC(C(C(C)C)=Cc2c(OC)cc(CCCCC)cc2O)C(C(=O)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.012
InChIKey:ZHXWRFKMAHNLQV-UHFFFAOYSA-N
ID: 139427
SMILES:C1C(CC=C)=C(O)C(=O)C2=C1C1C3C(C(C)(C)Oc4cc(C)cc(O)c41)C(=O)CC3(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.504
CB1 binding score: -15.024
InChIKey:DEGAHGQWIXUZGC-UHFFFAOYSA-N
ID: 139428
SMILES:C(C=C(C)CCC=C(C)C)Oc1c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.108
InChIKey:HUOSBKDCWCFSDM-UHFFFAOYSA-N
ID: 139429
SMILES:C(C(OC)=O)(C1CC2c3c(O)c(C(=O)CCCCC)cc(C(C=C)(C)C)c3OC(C)(C)C2CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -16.613
InChIKey:GQKWWYHHKHAQCL-UHFFFAOYSA-N
ID: 139430
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 139431
SMILES:C(C)CC1=CC(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -11.745
InChIKey:VFJMYNXECVPMHF-UHFFFAOYSA-N
ID: 139432
SMILES:COc1c(OC)c(O)c2c(c1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -12.809
InChIKey:HZLGUBUWPRIQMF-UHFFFAOYSA-N
ID: 139433
SMILES:C12(C)C(O)CC(C)C(O)C1c1c(cc(CCCCC)cc1O)OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: Not available
InChIKey:DGQFUVSPOJYESX-UHFFFAOYSA-N
ID: 139434
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 139435
SMILES:C(C=O)CCc1cc(O)c(C2C(C(=C)C)CC(O)C(C)=C2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.581
InChIKey:LUKOCUDKFGTZFE-UHFFFAOYSA-N
ID: 139436
SMILES:c1(C(OC(C)c2ccccc2)=O)c(O)c2c(cc1CCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -13.928
InChIKey:WGQCQDCDGCONSF-UHFFFAOYSA-N
ID: 139437
SMILES:O1C(CC(=CCc2cc(OC)cc(C)c2OC)C)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.183
InChIKey:UEXVJGCJGRSUMB-UHFFFAOYSA-N
ID: 139438
SMILES:CC(=O)OC1(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.714
InChIKey:ZGBUXSUWJDZTPP-UHFFFAOYSA-N
ID: 139439
SMILES:c12c(cc(C)c(O)c1CCCCC)OC(C)(C)C1C2CC(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.14
InChIKey:FOVLSJCFMQHQNJ-UHFFFAOYSA-N
ID: 139440
SMILES:c1(CC(C)CC(c2c(O)c(CC=C(C)C)c3c(c2OC)OC(C)(CCC=C(C)C)c2ccccc2[nH]3)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 734.034
CB1 binding score: -12.033
InChIKey:PXCATASOHIFZHR-UHFFFAOYSA-N