ID: 94081
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94082
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.255
InChIKey:UOILRNZARQBMGB-UHFFFAOYSA-N
ID: 94083
SMILES:C(CCCCC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)C=C1)CCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -14.958
InChIKey:CLECRJJCHPZNCD-UHFFFAOYSA-N
ID: 94084
SMILES:CC(c1c(OC2C=C(C)CCC2C(C)C)c(O)cc(CCCCC)c1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -15.497
InChIKey:HGGNVLOEFWRDCC-UHFFFAOYSA-N
ID: 94085
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(O)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 94086
SMILES:O=C(C1=CCCC(C)C12CC(C(C)(C)Oc1cc(CCCCC)cc(O)c1)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.937
InChIKey:MGFVMOXQPUZHEP-UHFFFAOYSA-N
ID: 94087
SMILES:CC1(CC=C(CCC=C(C)C)C)C(O)CC2c3c(cc(C)cc3OC)OCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.605
InChIKey:PNFQRJZDDRMPOQ-UHFFFAOYSA-N
ID: 94088
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC1(C(=C)C)CC(C)C=C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.998
InChIKey:DEKVXGHESQUEGU-UHFFFAOYSA-N
ID: 94089
SMILES:C1CC(CC(C)O)c2c(O)cc(CCCCC)c(C(=O)O)c2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -13.99
InChIKey:RQAAHORMZSQLSL-UHFFFAOYSA-N
ID: 94090
SMILES:CC(C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 94091
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(C)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 94092
SMILES:C1(C)=CC2(O)C(CC1)C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.313
InChIKey:XIIAOXXFRJHRGJ-UHFFFAOYSA-N
ID: 94093
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 94094
SMILES:OC1(C)C(C)(CC(C)=C(C)C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.562
InChIKey:CDXCYPGARFOTJW-UHFFFAOYSA-N
ID: 94095
SMILES:CCCCCCCCCCCCCc1c(C)c(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -15.334
InChIKey:SUVRCUXJXBQUNT-UHFFFAOYSA-N
ID: 94096
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.797
InChIKey:UQOUHXDCXBITSF-UHFFFAOYSA-N
ID: 94097
SMILES:C1(C)=CC2(C=C(C)C(O)C2)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -14.765
InChIKey:MPYKOAWECQRVMC-UHFFFAOYSA-N
ID: 94098
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 94099
SMILES:C(=O)(O)CCCCc1cc2c(c(O)c1)C1C(C(CO)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.848
InChIKey:ZDRLKQGGEFREFD-UHFFFAOYSA-N
ID: 94100
SMILES:C1=C(C(=O)O)C2C(O1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.288
InChIKey:VSJOJLNKPXFARL-UHFFFAOYSA-N
ID: 94101
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C(O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.764
InChIKey:MKRXCYIPYZZVMN-UHFFFAOYSA-N