ID: 110293
SMILES:C(=CCCc1cc2c(c(O)c1)C1C=C(CO)C(=O)CC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.528
InChIKey:DOAZRAQTLRIVKU-UHFFFAOYSA-N
ID: 110294
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 110295
SMILES:O=C(O)c1c(CC)c(CC)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.522
InChIKey:UWPAVIMFWBEFDR-UHFFFAOYSA-N
ID: 110296
SMILES:C1C(COC(=O)C)=CC2c3c(cc(CCCCC)c(C(OC)=O)c3O1)OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.739
InChIKey:CPIUDIMEEPKMLH-UHFFFAOYSA-N
ID: 110297
SMILES:CC1(O)CCC(C)(C)C2C1c1c(cc(CCCCC)cc1OC(C)=O)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.233
InChIKey:NKMHCHGHWFPZMY-UHFFFAOYSA-N
ID: 110298
SMILES:CC1=CCC2C(C1)c1c(cc(CCCCC)cc1OC(=O)C)OCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.115
InChIKey:VGOQZTLVBYJXNO-UHFFFAOYSA-N
ID: 110299
SMILES:Oc1c(CC=C(C)C)c(CC=C(C)C)c(O)c2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.308
InChIKey:FTUQOYMFCVUYMQ-UHFFFAOYSA-N
ID: 110300
SMILES:C1(O)(C)C(O)C2c3c(O)cc(CCCCC)cc3OC1(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.248
InChIKey:SQYOHBBMZOGHHF-UHFFFAOYSA-N
ID: 110301
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.616
InChIKey:XADHVNDJRGVZCL-UHFFFAOYSA-N
ID: 110302
SMILES:C(c1c(C)ccc(C)c1CCc1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -6.327
InChIKey:JSQONRCBOXIPAU-UHFFFAOYSA-N
ID: 110303
SMILES:C(C=C(C)C)CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 110304
SMILES:C(C=C(C)C)(Cc1cc(O)cc(CCCCC)c1)=O
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 260.377
CB1 binding score: -16.438
InChIKey:LLPVGRCFLPHTFN-UHFFFAOYSA-N
ID: 110305
SMILES:C1CC(C)=CC(c2c(OC)ccc(CCCCC)c2)=C1CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.858
InChIKey:WWVDVQXIHPKLRX-UHFFFAOYSA-N
ID: 110306
SMILES:C(CCCCCc1cc2c(c(O)c1)C1CC(C(C)C)C2=CCC1C)(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: -8.848
InChIKey:UBYKCGOMQJDFSQ-UHFFFAOYSA-N
ID: 110307
SMILES:c1(C)c(CCCC(C)=O)cc2c(c1)OC(C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.64
InChIKey:WSJLUDLPQYXAHG-UHFFFAOYSA-N
ID: 110308
SMILES:C12(C)C3C(C(O)(C)CCC4OC(C5=CC(C)(C)O1)C243)OC(C)(C)O5
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -14.828
InChIKey:LVIIGGFSVBWNNO-UHFFFAOYSA-N
ID: 110309
SMILES:Oc1c(CC=C(C)CCC=C(C)C2CC(=O)OC2(C)C)cc(OC)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.589
InChIKey:KSKBRGYPGPDKQT-UHFFFAOYSA-N
ID: 110310
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 110311
SMILES:CC1(C(CC=C(C)C)=O)CC(c2c(O)cc(CCC)cc2O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.499
InChIKey:ZLUTYSRFTYUMKZ-UHFFFAOYSA-N
ID: 110312
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.461
InChIKey:BXDOBWMDKVXMSO-UHFFFAOYSA-N
ID: 110313
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N