ID: 42064
SMILES:C1(C)=CC2c3c(cc(C)c(O)c3)OC(C)(C)C2CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 272.344
CB1 binding score: -17.952
InChIKey:CLFHOLPMPFYSHV-UHFFFAOYSA-N
ID: 42065
SMILES:C12C(Cc3c(c(C(=O)OC)ccc3O)OC1(C)C)CC(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -16.015
InChIKey:AAHWXEXXXJSWQS-UHFFFAOYSA-N
ID: 42066
SMILES:C1CC(C)CC2=C(C1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.254
InChIKey:FLAXRDLTAHKKLR-UHFFFAOYSA-N
ID: 42067
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCc2cc(C(C)C)c(O)c(C=O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: Not available
InChIKey:OUBZVGRALWSOPQ-UHFFFAOYSA-N
ID: 42068
SMILES:C(C(CC)C)c1c(O)ccc(O)c1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.916
InChIKey:UJCHCJVTYJMJDF-UHFFFAOYSA-N
ID: 42069
SMILES:C1C2c3c(cc(CCCCC)cc3OC2(C)C)C(=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.398
InChIKey:YYZTVANAQXEDAZ-UHFFFAOYSA-N
ID: 42070
SMILES:OC12C(C)=CC(c3c(cc(CCCCC)cc3O)O1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.273
InChIKey:YGUOKFFYPAOWHF-UHFFFAOYSA-N
ID: 42071
SMILES:C(=O)(c1cnccc1)C1CCC2(C)C(OC(C)=O)CC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 535.681
CB1 binding score: -13.179
InChIKey:GRBPBWXYZGGUBH-UHFFFAOYSA-N
ID: 42072
SMILES:C(CCC(OCc1cc(O)c(CC=C(C)C)c(O)c1)=CC(C)C)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -11.804
InChIKey:UWRBYGKQVSBICT-UHFFFAOYSA-N
ID: 42073
SMILES:CC1(O)C2c3c(OC(=O)C)cc(CCCCC)cc3OC(C2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.429
InChIKey:XGSNXHOMVXLCMN-UHFFFAOYSA-N
ID: 42074
SMILES:COc1c(O)c(O)c(OC)cc1CC1C(CCC=C(C)C)=CCC2CCC(C)=CC1C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.513
InChIKey:UNLSIGKAMXSDBB-UHFFFAOYSA-N
ID: 42075
SMILES:C1=CC(C)C(c2cc(CCCCC)ccc2)C(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.406
InChIKey:QNGOYBMCTCJYAX-UHFFFAOYSA-N
ID: 42076
SMILES:c1(O)cc(CCCCC)c(C(O)=O)c(O)c1CC1C(C)(C)C(C)CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.804
InChIKey:FHKRYCSWDYYHLE-UHFFFAOYSA-N
ID: 42077
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)c(OC)c(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.847
InChIKey:GFRAVQOMDVBPPQ-UHFFFAOYSA-N
ID: 42078
SMILES:c12c(cc(C)cc1O)OC(C)(C)C1C(CCC(C)=CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.41
InChIKey:JMFBBDDBEIKFCQ-UHFFFAOYSA-N
ID: 42079
SMILES:C1C(C(=C)C)C(c2c(O)cc(CC)cc2O)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.413
InChIKey:CBPWDDBVKIFXRH-UHFFFAOYSA-N
ID: 42080
SMILES:Oc1cc(CCc2ccccc2)cc(OC)c1C1C(C(CCC=C(C)C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -16.813
InChIKey:XNTICOXAURZPEU-UHFFFAOYSA-N
ID: 42081
SMILES:CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 42082
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.427
InChIKey:XQDZPPPNDMZKGW-UHFFFAOYSA-N
ID: 42083
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2=C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 42084
SMILES:C1(C)(C)C2C(Cc3cc(CO)ccc3O1)C(C)CCC2C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.732
InChIKey:GMQPHCAHEQFPDD-UHFFFAOYSA-N