ID: 115879
SMILES:c1(CC(O)C(O)(C)C)ccc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.329
InChIKey:HYMBPUQFYXREQZ-UHFFFAOYSA-N
ID: 115880
SMILES:CC1(C)C2C(O)(Cc3c(cc(CCCCC)cc3O)O2)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.103
InChIKey:OBGQSACYPKYAMQ-UHFFFAOYSA-N
ID: 115881
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C(=O)C2(O)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.074
InChIKey:SHXYJHFHEWZJAJ-UHFFFAOYSA-N
ID: 115882
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.522
InChIKey:XTHXQACBFDXOKH-UHFFFAOYSA-N
ID: 115883
SMILES:C1(O)CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 115884
SMILES:CC1(C)C2C(=CN(C(C)C)C(C)C)C(=O)C(C)=CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.64
CB1 binding score: -12.769
InChIKey:JXVOQKKTZNRUQB-UHFFFAOYSA-N
ID: 115885
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 115886
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)cc(CO)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.441
InChIKey:UKTGXEQHQBLPRE-UHFFFAOYSA-N
ID: 115887
SMILES:C(C=C(C)C)CC(C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.55
InChIKey:NZQIVXGJWIBAGK-UHFFFAOYSA-N
ID: 115888
SMILES:Oc1c(C2C=C(C)CCC2C(C)(O)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 115889
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CC1(C)C(CCC(C)=C1)C2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -13.457
InChIKey:XGLBDLWRZLHSAT-UHFFFAOYSA-N
ID: 115890
SMILES:C1CC(C)CC(c2c(O)ccc(CCCCC)c2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.997
InChIKey:ADPLRXMIJCNMOY-UHFFFAOYSA-N
ID: 115891
SMILES:c1(O)cc(C)c2c(c1CCCC)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.531
InChIKey:HRQSEQPRQYEESQ-UHFFFAOYSA-N
ID: 115892
SMILES:C1=C(C)CC(c2c(O)cc(CCC)cc2C)C(C(CCC=C(C)C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -16.175
InChIKey:DADJAHUUJCOHDQ-UHFFFAOYSA-N
ID: 115893
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 115894
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 115895
SMILES:C(c1c(OC(=O)C)c(OC(C)=O)cc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.563
CB1 binding score: -18.389
InChIKey:FFKSWILWNSTFKE-UHFFFAOYSA-N
ID: 115896
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 115897
SMILES:c1(O)c(OC)c(OCC(O)C(C)=C)c2c(c1)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -12.566
InChIKey:KZFHEWUWCVRPFX-UHFFFAOYSA-N
ID: 115898
SMILES:Oc1cc(CCCC(O)=O)cc2c1C=CC(C)(CCC=C(C)CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.897
InChIKey:CBXHMINPNHETPS-UHFFFAOYSA-N
ID: 115899
SMILES:CC(CC=CC(OC)(C)C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 360.538
CB1 binding score: -16.015
InChIKey:VFMXABLYCXOQAQ-UHFFFAOYSA-N