ID: 115060
SMILES:O(C(C)=O)C1CC2(C)Oc3c(c(O)cc(C)c3)CC2C=C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -12.171
InChIKey:UEUBBKVCFMNWPH-UHFFFAOYSA-N
ID: 115061
SMILES:c12ccc(CCCCC)cc1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.649
InChIKey:CBFJCKSFJPWQQA-UHFFFAOYSA-N
ID: 115062
SMILES:c12c(cc(O)cc1C)C(C)(C)Oc1c-2cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -13.749
InChIKey:BEEWPVZNSHBHRU-UHFFFAOYSA-N
ID: 115063
SMILES:C1C(C)=CC(c2c(O)c(C(C)CC)cc(CC=C(C)CCC=C(C)C)c2O)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.68
CB1 binding score: -16.029
InChIKey:TXSCTLODXIUEIK-UHFFFAOYSA-N
ID: 115064
SMILES:C12(O)C(c3c(cc(CCCCC)cc3O)O1)C(O)(C(=C)CO)CCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.021
InChIKey:KUBSAGMPFVMRPA-UHFFFAOYSA-N
ID: 115065
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 115066
SMILES:C1(CC(C=O)=CCC2c3c(O)cc(CCC)cc3OC2(C)C)C(=O)N(C)C(C(C)O)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 443.54
CB1 binding score: -15.047
InChIKey:BOQSNTSADHAMRI-UHFFFAOYSA-N
ID: 115067
SMILES:Oc1c(O)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.236
InChIKey:GJBKAKGBGYJUCA-UHFFFAOYSA-N
ID: 115068
SMILES:c12c(OC)cc(O)cc1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 115069
SMILES:C1=C(C)CC2C(C(OO)C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.36
InChIKey:SGKOSCJMXRLASH-UHFFFAOYSA-N
ID: 115070
SMILES:C1(C(C)(C)O)Cc2c(O)cc(CCC)cc2OC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -16.361
InChIKey:CLOFAAMFPMXCOZ-UHFFFAOYSA-N
ID: 115071
SMILES:CC(C)=CCCC1(C)Oc2cc(C)cc(O)c2C2OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids;Miscellaneous meroterpenoids
MW: 330.468
CB1 binding score: -13.143
InChIKey:CFOPPCVLTNECQQ-UHFFFAOYSA-N
ID: 115072
SMILES:C1=C(C)C(O)C(c2c(O)cc(CCC)cc2O)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.386
InChIKey:QRXCPGCYEJUEGZ-UHFFFAOYSA-N
ID: 115073
SMILES:C1=C(C(O)=O)CCC2C(C)(C)Oc3cc(CCCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17
InChIKey:CGYHWLVCHKZQHO-UHFFFAOYSA-N
ID: 115074
SMILES:Oc1cc(CCCCC)c(O)cc1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 115075
SMILES:C1(CC)(C)CCC2C(C1C)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -13.357
InChIKey:VUQWOYRUXTZNGP-UHFFFAOYSA-N
ID: 115076
SMILES:CC(C)C1(O)C(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.706
InChIKey:HPHVXWBCWKSUIV-UHFFFAOYSA-N
ID: 115077
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C1=O)C1(C)C(CC=C2C)OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.83
InChIKey:BQCHNXZSUBESOA-UHFFFAOYSA-N
ID: 115078
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.882
InChIKey:UEFGHYCIOXYTOG-UHFFFAOYSA-N
ID: 115079
SMILES:c1(OC)c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 115080
SMILES:C1(C)(C)C2=C(c3c(cc(CCCCC)cc3O)O1)CC(CC=C(C)C)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.548
InChIKey:NOXHFCDFKBNCST-UHFFFAOYSA-N