ID: 58255
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(OC(=O)C(=CC)C)C(C)(OC(C)=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -14.572
InChIKey:ZFBHARIAKRIHJN-UHFFFAOYSA-N
ID: 58256
SMILES:C1=CC(C)(CCC=C(C)C)Oc2c1c(O)c(CCC)cc2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.619
InChIKey:ADXDOXHSRNCOQZ-UHFFFAOYSA-N
ID: 58257
SMILES:CC(C1=CC(=O)C(=O)C(C)CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.534
InChIKey:ZVEXEWIVSFLTHF-UHFFFAOYSA-N
ID: 58258
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(CCC=C(C)C)=C)cc1)(O)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -14.683
InChIKey:YLLIWEOXCMDXPI-UHFFFAOYSA-N
ID: 58259
SMILES:C1=C(C)CCC(C(C)(O)CCC=C(C)C)C1c1c(O)cc(CC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.023
InChIKey:USQQTPAPRTUCRN-UHFFFAOYSA-N
ID: 58260
SMILES:c1(OCC)c(O)c2c(cc1CCC)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.817
InChIKey:VLJMFIQBUQRZCQ-UHFFFAOYSA-N
ID: 58261
SMILES:Oc1cc(CCCCC)cc2c1C1C=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: 58262
SMILES:C1C2c3c(cc(CCCCC)cc3OC)OC3(C)Oc4c(c(C)c5c(c4)C4(C)C(CC5)C(C)(C)C(=O)C=C4)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.716
CB1 binding score: -13.838
InChIKey:MKLZVBLHNRVFBQ-UHFFFAOYSA-N
ID: 58263
SMILES:C(C)(=CCCC(=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 58264
SMILES:C1C2OC2(C)C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.388
InChIKey:QYLDBDSWRTVRQV-UHFFFAOYSA-N
ID: 58265
SMILES:C1CC2(C)C(C)(Oc3cc(CCCCC)cc(O)c32)C2CCC(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -18.099
InChIKey:MPJUAINYYKXKQJ-UHFFFAOYSA-N
ID: 58266
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CC=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.585
InChIKey:NZUUGMLOXJAJLR-UHFFFAOYSA-N
ID: 58267
SMILES:CC1CC(c2c(O)cc(O)cc2CCCCC)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -18.753
InChIKey:BHQDJFJOVJDCDO-UHFFFAOYSA-N
ID: 58268
SMILES:c12cc(O)c(C(=O)C(CC)C)cc1OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -18.53
InChIKey:GPOSYNVWJGOIRV-UHFFFAOYSA-N
ID: 58269
SMILES:c1(CCCCC)cc(O)cc2c1CC(C(CO)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.53
InChIKey:XNXMLLGILGGEQQ-UHFFFAOYSA-N
ID: 58270
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -20.03
InChIKey:LXMICYYYVWWGAM-UHFFFAOYSA-N
ID: 58271
SMILES:c1(C(O)=O)cc(CCCCC)cc2c1OC(C(O)(C)C)CC1=C2CC2C(C)(CCCC2(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -13.002
InChIKey:SLRSQTSEUYMCOL-UHFFFAOYSA-N
ID: 58272
SMILES:Oc1c2c(c(C)c(C)c1CC(=O)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.788
InChIKey:RCGDURLGZKFUOC-UHFFFAOYSA-N
ID: 58273
SMILES:C(=C(C)CCC=C(C)C)COc1c(C(=O)CC(C)C)c2c(cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.929
InChIKey:BUWACGTUFCNFDL-UHFFFAOYSA-N
ID: 58274
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)C3OC(CCC=C(C)C)(C)C(CC1)CC(C1C(C)(C)CCC=C21)C3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.808
CB1 binding score: -14.698
InChIKey:VTADSFUXLTWLLL-UHFFFAOYSA-N
ID: 58275
SMILES:CC(=CC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.743
InChIKey:PBURYKCWSYAACH-UHFFFAOYSA-N