ID: 97735
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(O)(C)CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.655
InChIKey:FHBKGUVKPKDHKT-UHFFFAOYSA-N
ID: 97736
SMILES:CC1(CCC=C(C)C)C2C(c3c(cc(C)cc3O)O1)C(=C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.383
InChIKey:DJWDAZNFSHDIRW-UHFFFAOYSA-N
ID: 97737
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(O)cc(CCc4ccccc4)c3C12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -16.521
InChIKey:KWQKEIYAUXPTSL-UHFFFAOYSA-N
ID: 97738
SMILES:c1c(C(C)C(C)O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.003
InChIKey:KLSQNKSYCDGFGS-UHFFFAOYSA-N
ID: 97739
SMILES:C12(C)C(C)=C(C(=O)C1)C(C)(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.535
InChIKey:KDRKBDIOBAAOMS-UHFFFAOYSA-N
ID: 97740
SMILES:CC12CC(c3cc(C(=O)OC)c(CCCCC)cc3O1)C1C(CC2)C1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 384.56
CB1 binding score: -16.124
InChIKey:ILAAWCQEKXUBBS-UHFFFAOYSA-N
ID: 97741
SMILES:c12c(cc(CCCCC)cc1O)C(=O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -19.234
InChIKey:ZYJFWYNKEDPELE-UHFFFAOYSA-N
ID: 97742
SMILES:CC1=CC(CC(=C)C=Cc2c(O)cc(CCCCC)cc2O)OC(C)(C)C=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.184
InChIKey:WAWGFAXZCZTQPE-UHFFFAOYSA-N
ID: 97743
SMILES:C(CCC)Cc1cc2c(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: 97744
SMILES:O=C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)C21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.481
InChIKey:HQIHECVMFFYROS-UHFFFAOYSA-N
ID: 97745
SMILES:c12c(C(C(CC)C)=O)c(O)cc(O)c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.604
InChIKey:VWTHNNZUPUPSLT-UHFFFAOYSA-N
ID: 97746
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 97747
SMILES:Oc1c(C(CC(O)C)=O)c2c(cc1C(=O)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -16.055
InChIKey:OMOFCWXDFGUKEI-UHFFFAOYSA-N
ID: 97748
SMILES:C1(=O)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -13.929
InChIKey:BIXQTRYHBPIKAJ-UHFFFAOYSA-N
ID: 97749
SMILES:C1(c2c(OC(=O)C)cc(CCCCC)cc2O)CC(C)CCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.547
InChIKey:FFAXHXABPJJOCR-UHFFFAOYSA-N
ID: 97750
SMILES:c12c(OS(=O)(=O)O)cc(CCCCC)cc1OC(C)(C)C1=CCC(C)(O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.532
CB1 binding score: -12.225
InChIKey:BHIWVYUXNFVEKE-UHFFFAOYSA-N
ID: 97751
SMILES:OC(CO)(C1=CC2c3c(c(C(=O)O)c(O)cc3CO)OC(C)(C)C2C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.394
CB1 binding score: -15.55
InChIKey:KWLCDKSJHUAPTC-UHFFFAOYSA-N
ID: 97752
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)OC(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.641
InChIKey:YEAWHVGQWOSZNR-UHFFFAOYSA-N
ID: 97753
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2C1CCC1(C)C(O1)C=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.189
InChIKey:HDXKCBOGIMELNR-UHFFFAOYSA-N
ID: 97754
SMILES:COc1c2c(cc(CCCC)c1)OC(=O)C2CC(C(C)(CCC=C(C)C)O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.958
InChIKey:UKGOHVJCJGLKAZ-UHFFFAOYSA-N
ID: 97755
SMILES:CC1(C)C2=C(c3c(cc(CCCCC)c(C(=O)OC)c3O)OC2(C)C)CC1Cl
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.95
CB1 binding score: -16.202
InChIKey:MVXDUEVYEFUJBT-UHFFFAOYSA-N