ID: 91036
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 91037
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 91038
SMILES:c1(C(CO)O)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.354
InChIKey:KBQWYZFVCCGYKG-UHFFFAOYSA-N
ID: 91039
SMILES:C12C(Cl)C(Cl)(C)CC(O)C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 401.374
CB1 binding score: -16.409
InChIKey:AEZJLXRKZRPJSE-UHFFFAOYSA-N
ID: 91040
SMILES:C1(CO)C2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.824
InChIKey:LHMOEDODGJYZLZ-UHFFFAOYSA-N
ID: 91041
SMILES:O=C(OCc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.847
InChIKey:MVRVNPVQJPSPTF-UHFFFAOYSA-N
ID: 91042
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)(O)C=C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.573
InChIKey:GDXHYIZSNZOVBK-UHFFFAOYSA-N
ID: 91043
SMILES:CC(=CCC12CCC(C)(C)CC1c1c(O)cc(CCCCC)cc1O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -15.837
InChIKey:XGFVWIHHDLMROU-UHFFFAOYSA-N
ID: 91044
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.404
InChIKey:IBSBWOIOMTZHJY-UHFFFAOYSA-N
ID: 91045
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2=C(O)C(=O)c2c1ccc1c2C=CC(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.57
CB1 binding score: -15.021
InChIKey:KGEZJIBFWLDNAB-UHFFFAOYSA-N
ID: 91046
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.557
InChIKey:NDIKAOJIMBNANX-UHFFFAOYSA-N
ID: 91047
SMILES:Oc1c(C(=O)C)c2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.962
InChIKey:LGHULBBBFZVGRN-UHFFFAOYSA-N
ID: 91048
SMILES:CC(C)(O)C=Cc1c(O)c(C)c(C2C=C(C)CCC2C(=C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -8
InChIKey:XAFAEJZTJIINLH-UHFFFAOYSA-N
ID: 91049
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 91050
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 91051
SMILES:OC(=O)CCc1cc(O)cc(CC=C(CCC=C(C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.64
InChIKey:JJRKAQIZHVDOFJ-UHFFFAOYSA-N
ID: 91052
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CCCCCO)cc1OC1C(O)CC(COC(C(=CC)C)=O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.739
CB1 binding score: -15.944
InChIKey:SHLWRKLXFFAIOV-UHFFFAOYSA-N
ID: 91053
SMILES:CC1C2CCC(=C)C=C2c2c(cc(CCCCC)cc2O)OC(C)(C)C1CCC(O)(C)C#CCC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -15.485
InChIKey:UJEHCRWDFYCWJQ-UHFFFAOYSA-N
ID: 91054
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.522
InChIKey:MFVPLWAEUTVRGF-UHFFFAOYSA-N
ID: 91055
SMILES:c1(C(C)C)cc2c3c(c1)OC(C)(C)C1CCC(C)(CC13)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.565
InChIKey:MTKKZXTWYDHHDH-UHFFFAOYSA-N
ID: 91056
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N