ID: 116131
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1CS(O)(=O)=O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.542
CB1 binding score: -17.587
InChIKey:AWBKBCNPKJZZCR-UHFFFAOYSA-N
ID: 116132
SMILES:c1(CC)c2c(c(O)c(C(=O)CC(C)C)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.992
InChIKey:ASHHFPRCDPTDFZ-UHFFFAOYSA-N
ID: 116133
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 116134
SMILES:CCC(CCC(C)(O)C=C)C1C2OC(C)(C)C(O)C(c3c(O)cc(CCCCC)cc3O)C2C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.736
CB1 binding score: -16.594
InChIKey:XZAWFWIJMRXTMZ-UHFFFAOYSA-N
ID: 116135
SMILES:C1(O)C(C)=CC2C(C(C)(C)Oc3cc(C)c(OC)c(OC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.333
InChIKey:PNYGNTJDXMGFDR-UHFFFAOYSA-N
ID: 116136
SMILES:C(Cc1cc(C=O)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.766
InChIKey:GGJCMUCDFIOHRF-UHFFFAOYSA-N
ID: 116137
SMILES:C1C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C(CC(C)=C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.788
InChIKey:UHNIKJGIMZTAKJ-UHFFFAOYSA-N
ID: 116138
SMILES:O=C1C=C(C)CCC2C(C)(C)Oc3cc(c(O)cc3C(CCCCC)CSSC2O)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.785
CB1 binding score: -15.805
InChIKey:WYRLSECSASFRBL-UHFFFAOYSA-N
ID: 116139
SMILES:CN(c1cc(CCCCC)cc(OC(=O)C23C(CCC(=C)C2Cc2c(O)cc(CCC)cc2O)(C)C(C)CC3)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 561.807
CB1 binding score: -16.317
InChIKey:LBYDEGUIUDIMGR-UHFFFAOYSA-N
ID: 116140
SMILES:CC(CC(=O)C1=C(O)C(OCC)C(C)C2(CC3C4(C)C(CC=C3C)OC(C)(C)C4C2)O1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -13.249
InChIKey:XPLZQFJDTKRNSP-UHFFFAOYSA-N
ID: 116141
SMILES:C(CCC1=CCCC(C)(CC=CC(O)(C)C)O1)(C)=CCc1cc(O)cc(C)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.003
InChIKey:IISCVKBUQMWDCL-UHFFFAOYSA-N
ID: 116142
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 116143
SMILES:C(C)C=Cc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.478
InChIKey:GNQPSIKBWAUZND-UHFFFAOYSA-N
ID: 116144
SMILES:O=C1c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 116145
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 116146
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCC)cc2OC)C1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.904
InChIKey:CYFBETKVWBWDCK-UHFFFAOYSA-N
ID: 116147
SMILES:C12C(O)C(CO)=CC1c1c(ccc(CCCCC)c1)CC2(C)C(CC=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.148
InChIKey:WNJYOMBWZFCIMY-UHFFFAOYSA-N
ID: 116148
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116149
SMILES:c1(O)cc(CCCCCC)cc2c1C1C(C(C)(C)Oc3ccc(O)cc3C1=O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.494
CB1 binding score: -11.916
InChIKey:UECBJXHXWXGMDK-UHFFFAOYSA-N
ID: 116150
SMILES:C1(CC)=CCC(C(C)=C)C(c2cc(CCCCCC)cc(O)c2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.431
InChIKey:ROMVTHFANQDILA-UHFFFAOYSA-N
ID: 116151
SMILES:CC1=CC(c2c(O)ccc(C(OC)=O)c2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.003
InChIKey:VPSWYBOTFPOXLO-UHFFFAOYSA-N