ID: 70897
SMILES:C12C=C(CO)CCC1C(C)(C)Oc1c(C=O)c(C(=O)OC)c(CCCCC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.207
InChIKey:KVRUGMNUTBXPKT-UHFFFAOYSA-N
ID: 70898
SMILES:CC(C1C2(C)C(OC(=O)C)C(O)C3Oc4cc(CCCCCCCCC)cc(O)c4C3C2C(O)C1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -15.753
InChIKey:FTYBOVNNNLPJSK-UHFFFAOYSA-N
ID: 70899
SMILES:O(C1COc2c(cc(CCCCC)cc2O)OC1(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.391
CB1 binding score: -14.746
InChIKey:MRPXVBRGMOPORH-UHFFFAOYSA-N
ID: 70900
SMILES:C12(C)Oc3c(c(O)cc(CCC)c3)C(OC(=O)C)C1C(C)(C)C(OC(C)=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -16.811
InChIKey:VYJRUISSDDVONE-UHFFFAOYSA-N
ID: 70901
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 70902
SMILES:C1C2(C)C(Cc3c(OC(C)=O)cc(CCCCC)cc3O2)C2=CCCC(C)C2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.837
InChIKey:LRAXVZSCVKXHAY-UHFFFAOYSA-N
ID: 70903
SMILES:C(Cc1cc(O)cc(C2C=C(C)CCC2C(CCC(O)C(C)=C)=C)c1)C(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.425
InChIKey:HTOIOOUQQCFIMV-UHFFFAOYSA-N
ID: 70904
SMILES:Oc1c(C(=O)CCC(O)(C)C)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -15.82
InChIKey:VMYMVKORMULCLV-UHFFFAOYSA-N
ID: 70905
SMILES:C(CCCCCc1ccc2c(c1)OC(C)(C)C1CC=C(C)CC21)C(C(C)C)C1=C(O)C(C)(C)C(=O)C(C)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.808
CB1 binding score: -14.605
InChIKey:LCIFIEFREUYJIJ-UHFFFAOYSA-N
ID: 70906
SMILES:C(CCCCO)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 70907
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 70908
SMILES:C(C1CCC(C)=CC1c1c(OC(C)=O)cc(CCCCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.728
InChIKey:KHLGJPCISFQMLG-UHFFFAOYSA-N
ID: 70909
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(CO)=C)CCC(C)(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.519
InChIKey:PGPSWCWLEMQHKS-UHFFFAOYSA-N
ID: 70910
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(=O)O)c(C(O)CCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 376.493
CB1 binding score: -15.552
InChIKey:XRAFJGDQIDXVKN-UHFFFAOYSA-N
ID: 70911
SMILES:CC(=CCCC1(C=C)CCC=C1CCc1c(C)cc(O)cc1C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -12.741
InChIKey:HWHBZFPISJXEPY-UHFFFAOYSA-N
ID: 70912
SMILES:c12c(c(OC)cc(CC)c1)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -16.311
InChIKey:FQKJVASDWAGKHG-UHFFFAOYSA-N
ID: 70913
SMILES:C1CC2C(C)(Oc3cc(CCCCC)cc(O)c31)OC(C=C(C)C)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.76
InChIKey:KXVVCQVBSPAODT-UHFFFAOYSA-N
ID: 70914
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(O)(CO)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.211
InChIKey:IFVIOJVZRCYUQV-UHFFFAOYSA-N
ID: 70915
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 70916
SMILES:CC(=CCCC(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: 70917
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(=C)C)CCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -15.8
InChIKey:BPFZUVFUHBVILH-UHFFFAOYSA-N