ID: 111952
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 111953
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111954
SMILES:Oc1cc2c(c(O)c1CCCCC)C1CC(C(=C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.519
InChIKey:JSADXRVAQVOHIY-UHFFFAOYSA-N
ID: 111955
SMILES:C1C(C(C)(C)O)C(c2c(O)cc(CCCCC)cc2O)C2C(C)(O)CCC2C(C)(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 434.617
CB1 binding score: -16.002
InChIKey:ODICPZGUGMUTJQ-UHFFFAOYSA-N
ID: 111956
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC)c2CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -17.811
InChIKey:XGUNHTRLRAWUSH-UHFFFAOYSA-N
ID: 111957
SMILES:C1(C(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 111958
SMILES:C(CC(=CCc1c(OC)cc(CCCCC)cc1OC(C)=O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.187
InChIKey:ORYIHUPAYXEODQ-UHFFFAOYSA-N
ID: 111959
SMILES:c1(CC=C(C)C)ccc2c(c1)OC(C)(C)C1C(O)CC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 312.453
CB1 binding score: -16.964
InChIKey:COKNBHWGCBKCKU-UHFFFAOYSA-N
ID: 111960
SMILES:C1(CO)(C)C2CCC(C)=CCCc3ccc(CCCO)cc3OC(O1)C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -13.499
InChIKey:HFQWFRBAWUIWFG-UHFFFAOYSA-N
ID: 111961
SMILES:C1(=O)C(C)=CC(c2c(O)c(C(=O)OC)c(CCCCC)cc2O)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.954
InChIKey:PSUWYZOXCBERDF-UHFFFAOYSA-N
ID: 111962
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111963
SMILES:C12(CO)Oc3c(c(O)cc(C(C)C(OC(C)=O)C(CC)C)c3O)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -13.522
InChIKey:IRLMNDYCHDTKGW-UHFFFAOYSA-N
ID: 111964
SMILES:C1(C(C)C)C2CC2C(C)(Oc2cc(CCCCC)cc(C(=O)CCc3ccccc3)c2O)CC(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.766
CB1 binding score: -16.502
InChIKey:CPPGFVWDAAJMNC-UHFFFAOYSA-N
ID: 111965
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 111966
SMILES:CC1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2CC(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.824
InChIKey:BSUHEBPCOPXHBL-UHFFFAOYSA-N
ID: 111967
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)CCCCCC1C(=O)CC=C(C(=O)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: Not available
InChIKey:HIROTHIMIASIDE-UHFFFAOYSA-N
ID: 111968
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCC)c3)C2C2C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.206
InChIKey:MYICZUQFSGVHOM-UHFFFAOYSA-N
ID: 111969
SMILES:C1(C)=CC(c2c(CCCCC)cc(O)cc2O)C(C(C)=C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.135
InChIKey:MZLYUJJFIAMCDJ-UHFFFAOYSA-N
ID: 111970
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 111971
SMILES:c1(C2C(C(C)=C)C(c3c(O)cc(OC)cc3CCCCC)C=C(C)C2)c(O)cc(OC)c(Cl)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 501.063
CB1 binding score: -15.239
InChIKey:FMKBQMPFLFYKCN-UHFFFAOYSA-N
ID: 111972
SMILES:C1(CCC=C(CCC=C(C)C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N