ID: 94690
SMILES:CC(=CC(=O)c1c(O)cc(CCCCC)cc1OC1OC(CO)C(O)C(O)C1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.49
CB1 binding score: -14.948
InChIKey:YJFQFNKFIRSHDX-UHFFFAOYSA-N
ID: 94691
SMILES:CC1=C2C(C=C(C)C)Cc3c(c(C(O)=O)c(CCCCC)cc3O)OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.943
InChIKey:VRHCWBSELURFAF-UHFFFAOYSA-N
ID: 94692
SMILES:c12c(O)c(OC)cc(CCCCC)c1OC(C(CCC=C(C)C)(C)O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.956
InChIKey:QMNSJZZWKHRSDA-UHFFFAOYSA-N
ID: 94693
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94694
SMILES:C(CC)Cc1cc(O)cc2c1c1c(cc2O)OC(C)(C)C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: Not available
InChIKey:PZTDEZXMWJLRAO-UHFFFAOYSA-N
ID: 94695
SMILES:C(CCC(=O)C)C(c1c2c(c(O)c(C(=O)CC(C)C)c1O)C1C(C(C)(C)O2)CC=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.058
InChIKey:CRXXNHPCNPKVMS-UHFFFAOYSA-N
ID: 94696
SMILES:C(C)(C)=CCCC(=CCc1c(O)c(C(O)=O)c(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 94697
SMILES:O=C(OCC1C(O)C(O)C(O)C(Oc2cc(CC=C(C)C)c(CCCCC)cc2O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.572
CB1 binding score: -15.452
InChIKey:WZCOPPJNTGRQHZ-UHFFFAOYSA-N
ID: 94698
SMILES:c1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C(O)CCCCC)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.93
InChIKey:RFXFSFLVZLKZPS-UHFFFAOYSA-N
ID: 94699
SMILES:C1(C)=CCCC(=C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.098
InChIKey:FROFSQBYYIYUMC-UHFFFAOYSA-N
ID: 94700
SMILES:C(C)(=CCc1c(O)cc(CCc2ccccc2)cc1O)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 94701
SMILES:c1(CCCCC)cc(O)c2c(c1)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: 94702
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94703
SMILES:Oc1c(C(O)C(C)C)cc(O)c2c1C1C(CC=C(C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.302
InChIKey:KKIQQOYWJDHQGO-UHFFFAOYSA-N
ID: 94704
SMILES:C(C)(C)C1C(c2c(O)cc(CCCC)cc2O)OC(C)(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.489
InChIKey:PNGBSAOZCYCYDH-UHFFFAOYSA-N
ID: 94705
SMILES:C(C=C(C)C)CC(=CCc1cc(C(=O)O)c2c(c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.16
InChIKey:GVMMQPUHAOLSAQ-UHFFFAOYSA-N
ID: 94706
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 94707
SMILES:C(CC(C(C)=C)Cc1c(C)c2c(cc1C)OC(C)(C)CC2)c1c(O)ccc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -16.057
InChIKey:YNIRKNZTNNPRIG-UHFFFAOYSA-N
ID: 94708
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C=CC(C)(CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.527
InChIKey:WWOIDOCFHDFCHW-UHFFFAOYSA-N
ID: 94709
SMILES:O1C(CO)C(O)C(O)C(O)C1OC(C)(C)c1c(OC)ccc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.582
CB1 binding score: -15.506
InChIKey:VWMIPLTWMANOIK-UHFFFAOYSA-N
ID: 94710
SMILES:C(CCC(C(=C)C)C)c1c(O)c(CC=C(C)C)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 358.566
CB1 binding score: -14.542
InChIKey:MGPYKXGCQSBGAD-UHFFFAOYSA-N