ID: 129865
SMILES:O1c2cc(C)cc3c2C(C)(C(C(C)(C)O3)CCC)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.078
InChIKey:LCNUFUQOTPJGHP-UHFFFAOYSA-N
ID: 129866
SMILES:O=C(c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C2C(C(C)=C)CCC(C)=C2)c1O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.06
InChIKey:HWOZOMJAVNNRLF-UHFFFAOYSA-N
ID: 129867
SMILES:C(=C)(C)C1CCC(C(O)=O)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.686
InChIKey:LQHAPFLIUQWVJR-UHFFFAOYSA-N
ID: 129868
SMILES:O=C1CC2=CC(C1(C)OC(=O)C)C(CC(C)C)c1c(OC)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -13.815
InChIKey:UCZYCGDTCRSOAY-UHFFFAOYSA-N
ID: 129869
SMILES:C12C(C)=CC(C1C(C)C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.448
InChIKey:JYJLPUZADHETOE-UHFFFAOYSA-N
ID: 129870
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 129871
SMILES:c1(OC)c2c(cc(CCC[N+](C)=O)c1)OC(C)(C)C1CC=C(C)C(OC(C)=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.511
CB1 binding score: -14.605
InChIKey:RSCYTTIUMBQXRK-UHFFFAOYSA-N
ID: 129872
SMILES:CC1(OO)C=CC2C(C1)c1c(cc(CCC(=O)C)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.385
InChIKey:FIFIELDQBXOKSE-UHFFFAOYSA-N
ID: 129873
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 129874
SMILES:C1(OC(=O)C)C(C(=O)OC)=CC2C(C(C)(C)Oc3cc(C)cc(O)c31)CC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.416
CB1 binding score: -18.244
InChIKey:QBPWVVUJDRYDIV-UHFFFAOYSA-N
ID: 129875
SMILES:c1(O)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.637
InChIKey:CHUDUQRJNYLFSG-UHFFFAOYSA-N
ID: 129876
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)c(C(=O)C(C)CC)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.651
InChIKey:WHRFMIPXBWSESU-UHFFFAOYSA-N
ID: 129877
SMILES:C(CCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -18.334
InChIKey:HXPWAXPFMKPESR-UHFFFAOYSA-N
ID: 129878
SMILES:C(c1c(OC)c(O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.438
InChIKey:BOUINIAVXJXOAS-UHFFFAOYSA-N
ID: 129879
SMILES:C(C)=CC(=O)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -17.621
InChIKey:ZOUGSXNLHQPTTK-UHFFFAOYSA-N
ID: 129880
SMILES:C1(O)C2C(C)C(=O)CC12c1c(O)cc(CCCCC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -13.378
InChIKey:LOKMTXALYUJIGA-UHFFFAOYSA-N
ID: 129881
SMILES:CC1(O)C2c3c(cc(C)c(Br)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 341.245
CB1 binding score: -18.954
InChIKey:SLOJVMMBBUBJKX-UHFFFAOYSA-N
ID: 129882
SMILES:C1C(C)(C)Oc2cc(CCCCC)cc(OC)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.311
InChIKey:DKJVHSOAQAXREU-UHFFFAOYSA-N
ID: 129883
SMILES:C(C)(C)=C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.089
InChIKey:MXHIJQHAYHJSTF-UHFFFAOYSA-N
ID: 129884
SMILES:C(CCC)Cc1cc(O)c(O)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.915
InChIKey:LFOHLNWEMZXYBJ-UHFFFAOYSA-N
ID: 129885
SMILES:OC(c1c(O)c2c(cc1CCCCC)OC(C)(C)c1ccc(C)cc1-2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -17.564
InChIKey:KXKOBIRSQLNUPS-UHFFFAOYSA-N