ID: 41833
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(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: 41834
SMILES:C12(C(C)C)Oc3c(c(CCCCC)cc(OC)c3)CC1(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.101
InChIKey:ZASRQPHINCXCNQ-UHFFFAOYSA-N
ID: 41835
SMILES:c12cc(CCCCC)cc(O)c1oc(C)c1c(C3C4C(C)(O4)C4C(C(C)(O)CC4)C3)(C)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -17.033
InChIKey:QZQLADGSWDDLAM-UHFFFAOYSA-N
ID: 41836
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 41837
SMILES:C(Cc1c(CCC)cc(O)c(CC=C(C)CCC=C(C)C)c1O)(=O)C1(C)CCc2c(O)ccc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -14.582
InChIKey:XOPIZPZSOBDJAG-UHFFFAOYSA-N
ID: 41838
SMILES:C1(Cl)C2(O)C(C)(CCC(Br)C2(C)C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 459.852
CB1 binding score: -11.799
InChIKey:BPIFQSWPTBYHNX-UHFFFAOYSA-N
ID: 41839
SMILES:C(CC(C(C)C)C=CC(C)=C)C(=CCc1c(O)cc(CCc2ccccc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -15.355
InChIKey:KLPYXMWSGBXZAP-UHFFFAOYSA-N
ID: 41840
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(C)c3)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.466
InChIKey:OOSGYAFEZCZRRA-UHFFFAOYSA-N
ID: 41841
SMILES:C1=C(C)CCC(C(O)(C)C)C1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.257
InChIKey:KETCUGMUWAEENN-UHFFFAOYSA-N
ID: 41842
SMILES:C(Cc1cc(O)c2c(c1O)OC13C(=C(C)CCC1C(C)(C)O2)CCC3(O)C)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -13.58
InChIKey:WJAGIPSUOWHYKJ-UHFFFAOYSA-N
ID: 41843
SMILES:OC(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.141
InChIKey:HEEJEKKEYJPCFA-UHFFFAOYSA-N
ID: 41844
SMILES:C(c1c(OC)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.847
InChIKey:GFRAVQOMDVBPPQ-UHFFFAOYSA-N
ID: 41845
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 41846
SMILES:c12c(OC)c(O)c3c(c1C(=O)C(O)C(C)O2)OC(C)(C)C1C3CC(C)=CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -12.437
InChIKey:QJFIZRAZWKVABV-UHFFFAOYSA-N
ID: 41847
SMILES:Oc1cc(CCCCCC)cc2c1C1C(C(=C)C)CC(C)(CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.91
InChIKey:KARKVEAFVDRCBH-UHFFFAOYSA-N
ID: 41848
SMILES:CC(CC)C(c1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c1C2C)OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.603
InChIKey:CFPAEPYNVHJSKL-UHFFFAOYSA-N
ID: 41849
SMILES:COc1c(C)cc(O)c2c1-c1c(c(O)c(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -14.095
InChIKey:ZMXIUPFEQGIIJH-UHFFFAOYSA-N
ID: 41850
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C(O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 41851
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)cccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.03
InChIKey:FXCDESBUPRREJQ-UHFFFAOYSA-N
ID: 41852
SMILES:CC1(C)C2C(CC(C)=CC2)c2c(cc(C)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.091
InChIKey:DENJPBAXNZGHTK-UHFFFAOYSA-N
ID: 41853
SMILES:c1(O)c(C2=C(O)C(C)(C)C=CC2=O)c(O)c2c(c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -15.62
InChIKey:FHXYPFDPSACLGT-UHFFFAOYSA-N