ID: 58465
SMILES:C(c1c(O)c(C)cc(O)c1)CC(C)(CCC1(O)C=C(C)C(=O)O1)Cc1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.73
CB1 binding score: -13.851
InChIKey:JPDSMPSEBFVEIF-UHFFFAOYSA-N
ID: 58466
SMILES:C(C(=O)O)CC(C)=CCc1c(O)cc(CCCCC)c(C(=O)OC(C)=CC)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -17.633
InChIKey:RUCVWXSDSCDGLS-UHFFFAOYSA-N
ID: 58467
SMILES:C1CC2CC(C)(C1C(c1c(O)c(C(=O)O)c(CCCCC)cc1O)=O)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.432
CB1 binding score: -13.273
InChIKey:OXNQSZIEYUEXDT-UHFFFAOYSA-N
ID: 58468
SMILES:C(Cc1cc2c(c(O)c1)C1CC(CO)=CCC1C(C)(C)O2)=CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 358.478
CB1 binding score: -15.911
InChIKey:DEZQDOYDLIHMRK-UHFFFAOYSA-N
ID: 58469
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.93
InChIKey:KYZZGUCXNYLZKE-UHFFFAOYSA-N
ID: 58470
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C2=C(C=CC(C)(C)O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.491
InChIKey:CNDJYGPXEOZJGL-UHFFFAOYSA-N
ID: 58471
SMILES:C(CCC)(C=CCC(=CCc1c(O)c(C)cc(O)c1)C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -13.881
InChIKey:QSKSHYUGYCJAHX-UHFFFAOYSA-N
ID: 58472
SMILES:C1CC2(C)Oc3c(c(O)cc(CCC)c3)C(C1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.092
InChIKey:OYADLQSSTMNWPY-UHFFFAOYSA-N
ID: 58473
SMILES:C(CC)CCCc1cc(O)c(C2C=C(C)CC(c3c(OC)ccc(CC[N+](C)(O)CC)c3)O2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.685
CB1 binding score: -16.101
InChIKey:CLOISUWZIKAJAG-UHFFFAOYSA-O
ID: 58474
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c2c(O)cc(C(OC(=O)C)C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.625
InChIKey:FYIVBIUQXYBADA-UHFFFAOYSA-N
ID: 58475
SMILES:CC(CCC)Cc1cc(O)c(C2C(C(COC(=O)C)=C)CCC(C)=C2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.441
InChIKey:GVOHHDRJXRCFAA-UHFFFAOYSA-N
ID: 58476
SMILES:O1CC(Br)C(C)(Cl)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 391.733
CB1 binding score: -14.798
InChIKey:GAPTWUPYWDSVFJ-UHFFFAOYSA-N
ID: 58477
SMILES:OC1CC(C)=CC(CC(=CCc2c(O)c(C)cc(O)c2)C)C1(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.502
InChIKey:NMDWDLKNJABZDV-UHFFFAOYSA-N
ID: 58478
SMILES:C1CC(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 58479
SMILES:CCCCCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 58480
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 58481
SMILES:C1(C(C)=C)C2C(=C(C)CC1)c1c(c(O)c(CC=C(C)C)c(O)c1)OC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.562
InChIKey:TYAZFGRAFZAVBS-UHFFFAOYSA-N
ID: 58482
SMILES:Oc1c2c(cc(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 58483
SMILES:O1c2c(cc(CCCCC)cc2O)CC(C)C12C1(C)C(CC(C)=CCC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.438
InChIKey:ISDDZRFDZDEQKJ-UHFFFAOYSA-N
ID: 58484
SMILES:C(C)(CCCC1(C)Oc2c(cc(OC(C)=O)cc2C)C=C1)COC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.531
InChIKey:CDWMKNJRIOEFJF-UHFFFAOYSA-N
ID: 58485
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.582
InChIKey:PDYKIGRVNVKGPA-UHFFFAOYSA-N