ID: 51892
SMILES:CC1=C(c2cc(CCCCC)cc3c2OCC(CCC=C(C)C)=C3)OC(C(C)(O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -17.02
InChIKey:OQPPILFHRISGKR-UHFFFAOYSA-N
ID: 51893
SMILES:C12C(C(OC)=O)(c3c(O)cc(CCCCC)cc31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: Not available
InChIKey:WQRPQFWCZPCETF-UHFFFAOYSA-N
ID: 51894
SMILES:c1c2c(cc(CCCCC)c1)OC(C(C)(O)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.316
InChIKey:GOOVIKRDBAWBMD-UHFFFAOYSA-N
ID: 51895
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(COC(=O)C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.013
InChIKey:BSDLVSASMCJRGD-UHFFFAOYSA-N
ID: 51896
SMILES:C1(=O)C(C)(C(OC(C)=O)CC=C(C)C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -13.433
InChIKey:KBJZPFVCTHWOJD-UHFFFAOYSA-N
ID: 51897
SMILES:CC1=Cc2ccc(CCCC)cc2OC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: Not available
InChIKey:MSRUTUZPDIXVAN-UHFFFAOYSA-N
ID: 51898
SMILES:C(CCc1cc2c(c(O)c1)C(=O)CC(C)(C)O2)(C(C)(O)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merohemiterpenoids;Miscellaneous meroterpenoids
MW: 308.374
CB1 binding score: -15.32
InChIKey:HYIRYTQZTBHGKF-UHFFFAOYSA-N
ID: 51899
SMILES:O=C1C2C(C(=O)O1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.726
InChIKey:RVLHAZIIMHVIJH-UHFFFAOYSA-N
ID: 51900
SMILES:c1(C(CCC(O)=O)(C)O)ccc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.749
InChIKey:OBNLAIOICOKVCU-UHFFFAOYSA-N
ID: 51901
SMILES:C1CC(C)=CC(c2c(O)ccc(CCCCCO)c2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.187
InChIKey:GLFTUTFSSQRTJA-UHFFFAOYSA-N
ID: 51902
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 51903
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(C)c3)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 51904
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC4C(O)C(O)C(O)C(CO)O4)c3O2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -12.258
InChIKey:KXIRJHJKNPCJQZ-UHFFFAOYSA-N
ID: 51905
SMILES:C12CC(C)(O)C(O)CC1(O)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -15.514
InChIKey:LLRJPVHEDTXSBY-UHFFFAOYSA-N
ID: 51906
SMILES:OC1(CC=C(C)C)C(=O)C(OC(C)=O)(C)COc2c1c(C(C(CCCCC)=C)C)cc(O)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -17.321
InChIKey:HPSZMPFTIYUMHQ-UHFFFAOYSA-N
ID: 51907
SMILES:COc1c(C(=O)OC)c(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.071
InChIKey:VNOXVLYUFSTNRC-UHFFFAOYSA-N
ID: 51908
SMILES:C1=C(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: -16.481
InChIKey:YGQOYJUFZSNESF-UHFFFAOYSA-N
ID: 51909
SMILES:C1(C)=CC(c2c(O)cc(O)cc2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.171
InChIKey:HFDMGJLGHZDMNB-UHFFFAOYSA-N
ID: 51910
SMILES:C1(C)Oc2c(c(O)cc(CCCCC)c2)C2=CC(=O)CC(C)C12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: Not available
InChIKey:QEDQFLOAASGILT-UHFFFAOYSA-N
ID: 51911
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C=CC2C(C)(C)CCCC2C)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -15.257
InChIKey:LAWBPGPZKNMPOF-UHFFFAOYSA-N
ID: 51912
SMILES:C1=C(C)CCC(C(=C)C)Cc2c(ccc(CCCCC)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.954
InChIKey:CPMOOJXYOJUJIQ-UHFFFAOYSA-N