ID: 75076
SMILES:COc1c(C(O)=O)c(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.046
InChIKey:FQMZWLDPTILDHA-UHFFFAOYSA-N
ID: 75077
SMILES:C1CC2(C)Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C2C2C(C)(CCC1C(C)(OCC=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -15.56
InChIKey:IJLAURHVBJKGBR-UHFFFAOYSA-N
ID: 75078
SMILES:C1(C)(C)OC(C)(C(O)CCC(C)=CCc2c(O)c(C)cc(O)c2)CCC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -11.815
InChIKey:SEDIWAHJMPMJBO-UHFFFAOYSA-N
ID: 75079
SMILES:c12c(cc(CC=C)cc1)OC(C)(C)C1C2C=C(C(=O)OC)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.179
InChIKey:DFBYNJKSMHUPPG-UHFFFAOYSA-N
ID: 75080
SMILES:C12C(c3c(OC(C)=O)cc(CCCCC)cc3OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 75081
SMILES:C1=CC23C(C)(C)C(Br)(O)CC2(C)OC2=C(C(=O)C=C(C(CCC)C)C2=O)OC(C)(C)C13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 493.438
CB1 binding score: -14.336
InChIKey:HGMAFXRTDGWKBU-UHFFFAOYSA-N
ID: 75082
SMILES:CC(CCCC(c1c(O)c(C=O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.077
InChIKey:GUMMYKDAQNFROY-UHFFFAOYSA-N
ID: 75083
SMILES:C(CCCCCCC(=O)Oc1cc2c(cc1O)OC(C)(C)C1C2CC(C)=CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -16.134
InChIKey:HPCWMMPCZYRQIM-UHFFFAOYSA-N
ID: 75084
SMILES:Brc1c(C)cc2c(c1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.333
CB1 binding score: -18.264
InChIKey:SIKQYFZCSBPDDA-UHFFFAOYSA-N
ID: 75085
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)=C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -11.763
InChIKey:HTWHIAHCLIDSNS-UHFFFAOYSA-N
ID: 75086
SMILES:C12CC=C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 75087
SMILES:C(=O)(C)OC1C(C)=CCCC(C)=CCC2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.812
InChIKey:PJEVHYSGMMRFJY-UHFFFAOYSA-N
ID: 75088
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C(C3C1C(C)(C)C3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.041
InChIKey:AHTXOVSLXZHSOC-UHFFFAOYSA-N
ID: 75089
SMILES:Oc1c(C2C=C(C)CCC2C(=CCC=C(C)C)CO)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.46
InChIKey:RJQWHJOWKOJOKA-UHFFFAOYSA-N
ID: 75090
SMILES:c12c(O)cc(CCC)cc1OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.036
InChIKey:BTTRWQMCLAXICU-UHFFFAOYSA-N
ID: 75091
SMILES:CC1(C)C2CCC(=C)CC2c2c(c(O)cc(CCCCC)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.652
InChIKey:KUEUODCXBYBGDP-UHFFFAOYSA-N
ID: 75092
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 75093
SMILES:c1(OC)c(C2C=C(C)CCC2C(=C)C)c(C)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -16.751
InChIKey:DGFCSHDGQIITLF-UHFFFAOYSA-N
ID: 75094
SMILES:C(O)(C)(C)C1=C(O)C(=O)C2(C)Oc3c(c(OC)cc(CCCC)c3)C(O)C2C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -13.39
InChIKey:MRHWDMJEAGJAKV-UHFFFAOYSA-N
ID: 75095
SMILES:C1c2c(O)c3c(c(O)c2OC(CCCC(C)(C)O)(C)C1C(C)=C)CC(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -19.25
InChIKey:YBAWGILSDYMDLQ-UHFFFAOYSA-N
ID: 75096
SMILES:CC1(C)C2CCC(OC(=O)C)(C)CC2c2c(cc(C)c(C(O)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -15.358
InChIKey:IOIBNRUNIBVMLT-UHFFFAOYSA-N