ID: 139063
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 139064
SMILES:c1c2c(c(C=O)cc1)OC(C)(C)C1C2CC(COC(C)=O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -12.705
InChIKey:QNVZHZOTEKCOPB-UHFFFAOYSA-N
ID: 139065
SMILES:C(CC)CCc1cc2c(c(O)c1)C1CC(O)(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 139066
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(c(CCCCC)cc(O)c2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.83
InChIKey:JBVCMSKBEYIRGL-UHFFFAOYSA-N
ID: 139067
SMILES:C(C(C)=CCc1c(O)cc(C)cc1O)CC1=C(C)C(OC(=O)CCC)CCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.502
InChIKey:YIBMPBNTEVRITK-UHFFFAOYSA-N
ID: 139068
SMILES:C1(=O)C(CC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.14
InChIKey:ZPQNIQLZHSSRGA-UHFFFAOYSA-N
ID: 139069
SMILES:C1(C)C2CC(C2(C)C)CC1(O)c1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.188
InChIKey:UMWCEHYFQZTZKS-UHFFFAOYSA-N
ID: 139070
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.563
InChIKey:CODIXLGYYWMJFS-UHFFFAOYSA-N
ID: 139071
SMILES:C1(=C)C(OC(C)=O)CC2C(C1)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.315
InChIKey:RSPYHPJYRDHGAJ-UHFFFAOYSA-N
ID: 139072
SMILES:Oc1c(C(CCCCCCCCCCCCCCCCC)=O)cc(O)c(C2C=C(C)CCC2C(C)=C)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.829
CB1 binding score: -13.237
InChIKey:NVEDLFGBEAYBFS-UHFFFAOYSA-N
ID: 139073
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 139074
SMILES:c1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 139075
SMILES:OS(=O)(=O)c1c(N)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.549
CB1 binding score: -13.877
InChIKey:JJAXBNOWVUKBBB-UHFFFAOYSA-N
ID: 139076
SMILES:c1(O)c2c(cc(O)c1C(=O)C(C)C)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -18.462
InChIKey:CWZWDOSFIIRDNV-UHFFFAOYSA-N
ID: 139077
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2CC(C)(O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.509
InChIKey:XAJXLANJASZEBB-UHFFFAOYSA-N
ID: 139078
SMILES:c12c(c(O)cc(C)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 139079
SMILES:C1(C)(C)Oc2ccc(CCCCC)cc2CC1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -17.303
InChIKey:HIMCXEAFAHUSNM-UHFFFAOYSA-N
ID: 139080
SMILES:CC(O)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C(C(=C)C)OC(C(C)=CC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -16.13
InChIKey:VHQLGQFDHOMVRP-UHFFFAOYSA-N
ID: 139081
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)ccc(C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -18.086
InChIKey:OPSHXUAXEWBCRH-UHFFFAOYSA-N
ID: 139082
SMILES:C1(C)(C)C=CCC2(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.212
InChIKey:HZXOBIJSEFXBET-UHFFFAOYSA-N
ID: 139083
SMILES:C(CC(C)=CCc1c(OC)cc(CC(=O)O)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.388
InChIKey:YCPVZDZDYJRTCB-UHFFFAOYSA-N