ID: 92842
SMILES:CC1(C)C2Cc3ccc(CCCCC)cc3OC2(C)CCC1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.335
InChIKey:YWKILTKLYDFMOJ-UHFFFAOYSA-N
ID: 92843
SMILES:CC(OC1C=CC2(C(=O)C)c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.651
InChIKey:CPGYHLJIQSPWBN-UHFFFAOYSA-N
ID: 92844
SMILES:C1(Cl)CC2(O)C(C)(C)C(Br)C(O)CC2(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 489.878
CB1 binding score: -16.61
InChIKey:MHZLFNCPXJRJPX-UHFFFAOYSA-N
ID: 92845
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.431
InChIKey:MPYZLGRISYKSDV-UHFFFAOYSA-N
ID: 92846
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 92847
SMILES:C12(C)CCC3=C(C1CC1C2(C)Oc2c(c(C)cc(O)c21)O3)CC(=O)C(=C(C)C)C(CCC(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -12.798
InChIKey:GESOJCZLGKGWBF-UHFFFAOYSA-N
ID: 92848
SMILES:c1(=O)c(C)c(CCCCC)cc2c(c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.856
InChIKey:IYJYFFYPBFEGDB-UHFFFAOYSA-N
ID: 92849
SMILES:C1CC2(CO)CCC13C(c1c(cc(CCCCC)cc1O)O3)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.144
InChIKey:WSRRCGHZFGLRTF-UHFFFAOYSA-N
ID: 92850
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)c2c(cc1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -17.802
InChIKey:IGOJIKJIXBYNHZ-UHFFFAOYSA-N
ID: 92851
SMILES:C(CCC=C(C)C)(c1c(O)cc(C)c2c1-c1c(cc(CCCCC)cc1O)OC2(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -14.749
InChIKey:BMCIGSLAESRPCZ-UHFFFAOYSA-N
ID: 92852
SMILES:C1C(C)=CCC(C)(C)C=C2c3c(O)cc(CCCCC)cc3OC21C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.408
InChIKey:QUPVREDDNOTOST-UHFFFAOYSA-N
ID: 92853
SMILES:C12(C)C(OC(=O)C)CC(C(C)C)C1C1C(C)(CC2)Oc2cc(CCCCCCO)cc(O)c2-1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -14.399
InChIKey:JTRJFPZADVOYQH-UHFFFAOYSA-N
ID: 92854
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 92855
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 92856
SMILES:COc1c2c(c(COC(C(C)C)=O)cc1OC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: Not available
InChIKey:JTSBJFQMOBVAQV-UHFFFAOYSA-N
ID: 92857
SMILES:C123C(C)(C)C(OC4OC(C)C(O)C(O)C4O)CC(OC1=O)C3(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.619
CB1 binding score: -12.955
InChIKey:LYSSSNQPDSZYRA-UHFFFAOYSA-N
ID: 92858
SMILES:C12C3C(C)(C(O)CCC3=C)C=CC13C(C)CC(C)C2Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -14.756
InChIKey:INFBKFGNGCULNZ-UHFFFAOYSA-N
ID: 92859
SMILES:C(c1cc(CCCC(=CCc2cc(O)cc(C)c2O)C)=C(C)CCC1C(C)=C)(C)CCO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -13.223
InChIKey:ZQIGQRYFGZFGRZ-UHFFFAOYSA-N
ID: 92860
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(C)c(Cl)c2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.806
CB1 binding score: -17.304
InChIKey:RGFVZKCIBAZCKF-UHFFFAOYSA-N
ID: 92861
SMILES:C(CC=C(C)C)C(=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 92862
SMILES:C1(=O)C2C(C(C)(Oc3c(cccc3)C2)C)C(C)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:KYNLGQNCJOPLCL-UHFFFAOYSA-N