ID: 96055
SMILES:c1(COC2(C)C3CC(C(C)=C)CC(O)C3(C)CCC2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -14.093
InChIKey:KBZJYRUKJHXGQT-UHFFFAOYSA-N
ID: 96056
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 96057
SMILES:O(c1c(O)c2c3c(c1O)C=CC(CCC=C(C)C)(C)O3)OC(C)(C)C1C2C=C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.749
InChIKey:MDMHGGNSUSKXKM-UHFFFAOYSA-N
ID: 96058
SMILES:CC(C)=CCc1c(O)c(C2C3(C)C(C2=O)C2OC2(C)CC3)ccc1CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.12
InChIKey:RIWIWODQIMWVLC-UHFFFAOYSA-N
ID: 96059
SMILES:C(CC(=O)CC(C)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.195
InChIKey:OPOMGJRRZVBGSO-UHFFFAOYSA-N
ID: 96060
SMILES:C1=C(COC2C(O)C(O)C(O)C(CO)O2)CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.591
CB1 binding score: -12.814
InChIKey:KFWGCHVVCCXNHN-UHFFFAOYSA-N
ID: 96061
SMILES:C1C2=C(c3c(cc(CCCC)cc3)OC2(C)C)C(C)(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.242
InChIKey:PPIBZBBGTJPTGO-UHFFFAOYSA-N
ID: 96062
SMILES:c1(C2C=C(C)CCC2C(=C)C)cc(CCCCC)c(C(O)=O)c(CC=C(CO)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -11.597
InChIKey:ZUSMRZBLFFRBQF-UHFFFAOYSA-N
ID: 96063
SMILES:C1(C)C2CCC(=C)C=C2c2c(OC)cc(CCCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -12.152
InChIKey:UFNXJWQEBXIBPP-UHFFFAOYSA-N
ID: 96064
SMILES:CC1=CC(c2c(O)cc(CCC)cc2O)C(C(C(OC)=O)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.955
InChIKey:GAQBAWLFZJMNPM-UHFFFAOYSA-N
ID: 96065
SMILES:C(=CCC1(C)Oc2c(c(OC)cc(O)c2)C=C1)C(C)(CCC=C(C)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.887
InChIKey:YFHZSTJOSPVINK-UHFFFAOYSA-N
ID: 96066
SMILES:C(=C(C)CCC=C(C)C)CCC1(C)Oc2c(c3cc(C)c(CCCCC)cc3c(O)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.675
CB1 binding score: Not available
InChIKey:UCLGAOMQRCHQTH-UHFFFAOYSA-N
ID: 96067
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 96068
SMILES:C12C(C(C)C)C(c3c(cc(CCCCC)cc3O)O1)OC(=O)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.015
InChIKey:WZSRYXFDZFWNMI-UHFFFAOYSA-N
ID: 96069
SMILES:C12C(C=CC1)C(C)(C)Oc1c2c(O)c(OC)c(CCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -13.272
InChIKey:HAMPAHWIDUITHF-UHFFFAOYSA-N
ID: 96070
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.431
InChIKey:MPYZLGRISYKSDV-UHFFFAOYSA-N
ID: 96071
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 96072
SMILES:C1(C)(CCC=C(C)CCC(O)C(=C)C)Oc2cc(CCCCC)c(C(=O)OC)c(O)c2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.689
InChIKey:BDLOLGWBRUKMCG-UHFFFAOYSA-N
ID: 96073
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 96074
SMILES:CC(=O)OCC1C(O)C(O)C(O)C(OC2C(O)(C)CCC3C(C)(C)Oc4c(c(O)c(C(=O)O)c(CCCCC)c4)C32)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.67
CB1 binding score: -13.814
InChIKey:NKLGYOBWSXAROK-UHFFFAOYSA-N
ID: 96075
SMILES:c12c(c(C(C)C)ccc1C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -16.576
InChIKey:HEFGYDJFJNPDSB-UHFFFAOYSA-N