ID: 95992
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.929
InChIKey:BPDUWXNLWMFOLR-UHFFFAOYSA-N
ID: 95993
SMILES:C1C2C(C)(C)Oc3cc(C(C)C)cc(O)c3C12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -16.502
InChIKey:ROOZACAFFGCFQA-UHFFFAOYSA-N
ID: 95994
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(O)(CC(C)(C)O1)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.396
InChIKey:IEAKEBUZCRIPMK-UHFFFAOYSA-N
ID: 95995
SMILES:c1(CCCCCC)cc2c(c(O)c1C=O)CC(C(C)(C)O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -15.832
InChIKey:PVRFASVQBCXRTH-UHFFFAOYSA-N
ID: 95996
SMILES:CC1(C)C2C(c3c(OC)cc(CCCCC)cc3O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 95997
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(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: 95998
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 95999
SMILES:C12c3c(c(OC)cc(CCCCC)c3)OC(CCC=C(C)C)(C)C1CCC1(CO1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -12.184
InChIKey:IVCUCOGUXRUFLA-UHFFFAOYSA-N
ID: 96000
SMILES:C12C(=C)C(O)C(CC(=C)C)OC1(O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.682
InChIKey:SOQUMYAOAZBEGP-UHFFFAOYSA-N
ID: 96001
SMILES:C(C=C(C)C)CC(C)=CCc1c(O)cc(CCCCCO)c(C(=O)OC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 390.52
CB1 binding score: -15.107
InChIKey:BZFJUFNQAMHGGP-UHFFFAOYSA-N
ID: 96002
SMILES:CC1(C)C(c2c(O)cc(CCCCC)cc2O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -15.573
InChIKey:LKRFEZIOFUYAQP-UHFFFAOYSA-N
ID: 96003
SMILES:C12(C)C(O)CCC3=C(O1)c1c(cc(CCCCC)cc1O)C3O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.038
InChIKey:VOZWWZDZGODIEU-UHFFFAOYSA-N
ID: 96004
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC(OC)=O)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.313
InChIKey:KOQFZIWEDSSBOT-UHFFFAOYSA-N
ID: 96005
SMILES:O=c1cc2c(c(O)cc1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.226
InChIKey:OTVAUULCRIWVOO-UHFFFAOYSA-N
ID: 96006
SMILES:C(O)C1(C)Oc2cc(O)cc(C)c2C2CC(C)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.749
InChIKey:GAJJXLKZPJLRTH-UHFFFAOYSA-N
ID: 96007
SMILES:c1(C(O)(C)C)cc(O)c2c(c1)C(C)(CCCN(C)C)OC(C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 349.515
CB1 binding score: -12.008
InChIKey:AIXUFIYJZVVXHE-UHFFFAOYSA-N
ID: 96008
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -13.34
InChIKey:PXWJJAIAXGPAQV-UHFFFAOYSA-N
ID: 96009
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 96010
SMILES:C1(C)CCC2C(c3c(O)cc(CCCCC)cc3O2)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -13.791
InChIKey:CPGBWPUZEVEARF-UHFFFAOYSA-N
ID: 96011
SMILES:C(C1C2(O)C(C)(C(OC)C1)C1C(C)C(C)=CC(c3c(O)cc(CCCCC)cc3O1)O2)(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -16.21
InChIKey:BPNGBJYNTBQNMT-UHFFFAOYSA-N
ID: 96012
SMILES:C(C)CCCCCC(C(C)=CCc1c2c(c(O)cc1)C(=O)C1CC(O)CCC1(C)O2)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -13.625
InChIKey:OXMAURSYTXYTNP-UHFFFAOYSA-N