ID: 68083
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(OCC)=O)=C(C(O)C1)OC2=O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -15.072
InChIKey:OCFXENQKIIKFRS-UHFFFAOYSA-N
ID: 68084
SMILES:C1(=O)C(C)C2CC2C2(C)C3Oc4c(c(O)cc(CCCCC)c4)C3(C(OC)(C)CC1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -12.671
InChIKey:ZGKUFRYFKIRPQM-UHFFFAOYSA-N
ID: 68085
SMILES:C1=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.128
InChIKey:GYDWUKRZQJXBNL-UHFFFAOYSA-N
ID: 68086
SMILES:C(CCCC(C)C)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -19.765
InChIKey:ZFEXKIZLCYYFTO-UHFFFAOYSA-N
ID: 68087
SMILES:O=S(OCc1c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.527
CB1 binding score: -15.623
InChIKey:VGUBTLPDGGWLRD-UHFFFAOYSA-N
ID: 68088
SMILES:C(c1cc(O)c2c(c1)OC(c1ccc(O)c(OC)c1)C(C)(C)O2)CC(C)CCCC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.058
InChIKey:FBRYUAMXKXZMOE-UHFFFAOYSA-N
ID: 68089
SMILES:C12(C)Oc3cc(CCCC)c(C(O)=O)c(O)c3C1CC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -12.225
InChIKey:ZUPCIHRXDIEQIF-UHFFFAOYSA-N
ID: 68090
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C(C(C)(O)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.385
InChIKey:XGBLUBYIKPYOCW-UHFFFAOYSA-N
ID: 68091
SMILES:O(C)c1c(OC)c(C)c(Cl)c2c1C1C(C(C)(C)O2)CC=C(C)C1CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.967
CB1 binding score: -14.811
InChIKey:CJOYQLKWCZZEFP-UHFFFAOYSA-N
ID: 68092
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 68093
SMILES:C12C(C)(CCCC1(C)C)Oc1c(c(OC)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.306
InChIKey:DAFWPKXRCIKQIT-UHFFFAOYSA-N
ID: 68094
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1CCC(C)(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.065
InChIKey:AZPQASWFJLWKOZ-UHFFFAOYSA-N
ID: 68095
SMILES:c1c(CCCCC)cc2c3c1OC1(C(C)C(OC(=O)C)CC1C(C)(C)O3)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.967
InChIKey:ALRVOKZJHLOMJR-UHFFFAOYSA-N
ID: 68096
SMILES:c1c(C)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 68097
SMILES:C1(C)CC(=O)C2(C)c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.394
InChIKey:DJZJSDJWBYONBN-UHFFFAOYSA-N
ID: 68098
SMILES:C(CC=C(C)C)(C(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.502
InChIKey:ZRNVZUDAGGPJKE-UHFFFAOYSA-N
ID: 68099
SMILES:C(Cc1cc(CC=C(CCC=C(C)C)C)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -12.962
InChIKey:OGNICAJNPLJOKP-UHFFFAOYSA-N
ID: 68100
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C=C(C)C)CC2(C)CCC1S
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.655
CB1 binding score: -15.108
InChIKey:DKYNJUZZGVGATH-UHFFFAOYSA-N
ID: 68101
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C(C)=C)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.519
InChIKey:FXTYTXWMHFSIAK-UHFFFAOYSA-N
ID: 68102
SMILES:C(CCCC)Cc1cc2c(c(OC)c1)C1C(C(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -13.687
InChIKey:LWUGMXOHXDVXBD-UHFFFAOYSA-N
ID: 68103
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(O)CC(C)=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.056
InChIKey:KANIFTSWORZPPJ-UHFFFAOYSA-N