ID: 66991
SMILES:C(CCC=C)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.998
InChIKey:KHPJSCHUZCESPG-UHFFFAOYSA-N
ID: 66992
SMILES:OC(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.362
InChIKey:YIZBSHBIMWJGIW-UHFFFAOYSA-N
ID: 66993
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(CO)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.615
InChIKey:VQPCQRLUWAHPML-UHFFFAOYSA-N
ID: 66994
SMILES:CC(C)(CC(c1c2c(c(O)cc1O)C1C=C(C)CCC1C(C)(C)O2)=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.899
InChIKey:OJXSKKXGNHNRCT-UHFFFAOYSA-N
ID: 66995
SMILES:c12c(O)c(C(=O)O)c(CCCCC)cc1OC(C)(C)c1c2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -17.564
InChIKey:KXKOBIRSQLNUPS-UHFFFAOYSA-N
ID: 66996
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 66997
SMILES:c1(C=O)c(OC)cc2c3c1OC(CCC(O)C(O)(C)C)(C)C1C(C3)C(C)(C)OC1=C(C(=O)O)C(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.576
CB1 binding score: -16.964
InChIKey:NWSGNLOWURSKFF-UHFFFAOYSA-N
ID: 66998
SMILES:C1CC2(C)C(=O)C(c3c(O)cc(CCCC)cc3O)CC2C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.957
InChIKey:ORNFKMGLRKXOBT-UHFFFAOYSA-N
ID: 66999
SMILES:C(C)(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 67000
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 67001
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)C(O)C(C)C1CCC(C)(O)C3CC=C(C)C(C1)C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -16.367
InChIKey:OIIXPNWBHKUQOM-UHFFFAOYSA-N
ID: 67002
SMILES:C1CC2(OC13C(C)(C)OOC3c1c(O)cc(CCCCC)cc1O)C=C(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.84
InChIKey:QHJQYVJWIAXKCP-UHFFFAOYSA-N
ID: 67003
SMILES:C1C(O)C(C)=CC2c3c(cc(CCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.523
InChIKey:AFGQLULYAGVAJY-UHFFFAOYSA-N
ID: 67004
SMILES:C(c1c(O)c(CC=C(CCC=C(C)C)C)c(O)c2c1OC(C)(C)C1C2CC(CO)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -18.433
InChIKey:VCIGOMQMIXOGHC-UHFFFAOYSA-N
ID: 67005
SMILES:CC(CCC=C(C)CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 67006
SMILES:C1(C(=C)C)C(C)(C=C)Oc2c(ccc(CCCCCC)c2)-c2cc(C)ccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.568
CB1 binding score: -14.105
InChIKey:NFOVMTKMFUUYPE-UHFFFAOYSA-N
ID: 67007
SMILES:C1(Br)C(O)CC(C)C2(COc3c(O)c(O)cc(CCCCC)c3)CCC12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.406
CB1 binding score: -15.132
InChIKey:YEFJQKYVIUQWTJ-UHFFFAOYSA-N
ID: 67008
SMILES:CN(C)CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 387.608
CB1 binding score: -16.194
InChIKey:QHVKVERXMZLYDQ-UHFFFAOYSA-N
ID: 67009
SMILES:C(c1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21)(C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.116
InChIKey:XBWLPMOHZNIIKV-UHFFFAOYSA-N
ID: 67010
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 67011
SMILES:O=C(OC1C(C2CC3C(C)(CC2)O3)c2c(cc(CCCCC)cc2O)OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -12.017
InChIKey:GKZNGTSKDSQCEO-UHFFFAOYSA-N