ID: 63568
SMILES:c1(CCC)cc2c(cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.74
InChIKey:WMPVHVZYTGKORK-UHFFFAOYSA-N
ID: 63569
SMILES:c12c(c(OC)cc(O)c1C(C(C)C)CCC(C)=O)CC1C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.457
InChIKey:DEUUQWMFPKXUPL-UHFFFAOYSA-N
ID: 63570
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 63571
SMILES:C(CCCCCCCCC)CCCCCC(=O)OCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C(OC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.811
CB1 binding score: -14.605
InChIKey:ALEBAPCMZFYUOM-UHFFFAOYSA-N
ID: 63572
SMILES:CC(=CCCC(C)=CCCC1(C)C=Cc2c(O)c(OC(=O)C)c(CCCCC)cc2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.382
InChIKey:QXBOWHYJQISLNZ-UHFFFAOYSA-N
ID: 63573
SMILES:C(C1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1)OC1OC(COC(C)=O)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.646
CB1 binding score: -16.007
InChIKey:AKWOILPHWMKNHZ-UHFFFAOYSA-N
ID: 63574
SMILES:c1(O)c(CC=C(C=CC=C(C)CCC(C(C)(O)C)OC2OC(COC(C)=O)C(OC(C)=O)C(O)C2O)C)cc(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 606.709
CB1 binding score: -11.879
InChIKey:LOEOUVOEVOHIEZ-UHFFFAOYSA-N
ID: 63575
SMILES:Oc1c2c(cc(CCCC)c1)OC(c1cc(C)c3c(c1)OC(C=C(C)CCC=C(C)C)C3)C=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.669
CB1 binding score: -15.358
InChIKey:MPDYFONRFGGNOL-UHFFFAOYSA-N
ID: 63576
SMILES:C12=C(c3c(O)cc(CCCCC)cc3OC1(C)C)C(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.078
InChIKey:MZMFRVHMYJFILG-UHFFFAOYSA-N
ID: 63577
SMILES:C1(C)(C)C2CCC(O)(C)CC2c2c(cc(CCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.488
InChIKey:SHKSNSDRGOBIPR-UHFFFAOYSA-N
ID: 63578
SMILES:c1c2c(c(C(=O)C=CC=CC(C=C(C=CC(CCC(=O)C)C(C)C)C)(C)O)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.775
CB1 binding score: -12.947
InChIKey:JMFFXAIKMFJMEE-UHFFFAOYSA-N
ID: 63579
SMILES:C12C3(C)Oc4cc(C)cc(O)c4C1(OC)C(C)=CCC2C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.016
InChIKey:OOIRDBMKDSZUJH-UHFFFAOYSA-N
ID: 63580
SMILES:C(CCCC)c1cc2c(c(O)c1)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 63581
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -16.337
InChIKey:BDIFHUPAMMQWHO-UHFFFAOYSA-N
ID: 63582
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N
ID: 63583
SMILES:C12=C(c3c(O)cc(CCCCC)cc3OC1(C)C)C(=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.865
InChIKey:KJHIMELHFHRNJT-UHFFFAOYSA-N
ID: 63584
SMILES:c1(CCCCC)cc2c(cc1)OC(C)(C)C1CCC(C)(O)C(OC(=O)C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.679
InChIKey:OUOOOXNPPMPZHY-UHFFFAOYSA-N
ID: 63585
SMILES:Oc1c2c(cc(CCCCC)c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.889
InChIKey:UQZHCXRAKGTLRR-UHFFFAOYSA-N
ID: 63586
SMILES:c1(O)c(CC=C(C)CCC=C(CCC2=C(C)CCCC2(C)C)C)c(O)c(C(=O)O)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.732
CB1 binding score: -15.372
InChIKey:BWGDBDOEZFZWBE-UHFFFAOYSA-N
ID: 63587
SMILES:NCCOc1cc(CCCC)ccc1C1C(C(CC)C)CC(C)CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 361.57
CB1 binding score: -14.448
InChIKey:PAWPSGNWRNZOJU-UHFFFAOYSA-N
ID: 63588
SMILES:C(C1CC2(O)c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.41
InChIKey:RDHBKIPWWCZPIB-UHFFFAOYSA-N