ID: 126715
SMILES:C(CCCc1cc(O)cc(CC=C(C)CCC=C(C)C)c1O)CC(C)=CCc1c(O)c(C(=O)OC)c(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 550.736
CB1 binding score: -12.8
InChIKey:GRTKOWVXUPTWJX-UHFFFAOYSA-N
ID: 126716
SMILES:C(CCC=C(C)C)(=CCCC(O)(C1Cc2c(O)cc(CCCCC)cc2O1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.402
InChIKey:QGZMHSPZPSOECK-UHFFFAOYSA-N
ID: 126717
SMILES:O1C2(C)C(C(C)(C)CCC2)Cc2c1cc(CCCCC)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 126718
SMILES:C1(O)C(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.723
InChIKey:GTLUOHHHNMCIQP-UHFFFAOYSA-N
ID: 126719
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(CO)CCC=C(C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -18.095
InChIKey:NWYNUCLRLSZSMF-UHFFFAOYSA-N
ID: 126720
SMILES:CC1(C)Oc2ccc(C=O)c(CCCCC)c2C(OC(=O)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.79
InChIKey:XVTFBYYMTGHBSQ-UHFFFAOYSA-N
ID: 126721
SMILES:O=C1CCC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(CO)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -12.662
InChIKey:OSGNNGDBLNZMLV-UHFFFAOYSA-N
ID: 126722
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc(O)c1CC1=C(O)C(CC(C(O)(C)C)O)C(C)(O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -15.473
InChIKey:XMHXLJHUOYOLBB-UHFFFAOYSA-N
ID: 126723
SMILES:c1(O)c(C=O)c(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.609
InChIKey:LLXDWVPVPRLKGY-UHFFFAOYSA-N
ID: 126724
SMILES:COC12C(=C)C(OCC)(OC(C)(C)C1CC(C)=O)c1c(cc(OC)cc1C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.502
InChIKey:SPPFVAYFPGQFIL-UHFFFAOYSA-N
ID: 126725
SMILES:CC(CC1CC2(C)CC3c4c(cc(CCCCC)cc4O)OC(C(C)(C)O)C3C2=C1C(CC)=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: Not available
InChIKey:LTCSOHYTYLVZNK-UHFFFAOYSA-N
ID: 126726
SMILES:C12C(C)(C)Oc3cc(O)cc(C)c3C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.35
InChIKey:XAYRLUBHJAOWEN-UHFFFAOYSA-N
ID: 126727
SMILES:OC12C(OC(=O)c3ccncc3N)C(C(C)C)CCC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.594
CB1 binding score: Not available
InChIKey:NKDUGBJUSARKDN-UHFFFAOYSA-N
ID: 126728
SMILES:C1=C(C)C(O)C(c2c(OC)c(CCCCC)cc(OC)c2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.706
InChIKey:XBBCUFLLMGVGLM-UHFFFAOYSA-N
ID: 126729
SMILES:CC1(C)Oc2cc(C)cc(O)c2C2CC(C)(O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.006
InChIKey:SUFPQJMELBBUPW-UHFFFAOYSA-N
ID: 126730
SMILES:c1(O)c(CC=C(CCC=C(CCC(C(O)(C)C)=O)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.771
InChIKey:VQLNTRFCJZFGDJ-UHFFFAOYSA-N
ID: 126731
SMILES:C12=C(CCC1(C)C)c1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)(O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.913
InChIKey:ZQBKIYNIVADNRT-UHFFFAOYSA-N
ID: 126732
SMILES:CC(=O)OC(C(OC1C(OC(=O)C(C)=CC)C(C)C(C2OC(=O)c3c(OC(C)=O)cc(CCCCC)cc3O2)C(C)=C1)=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 640.77
CB1 binding score: -15.747
InChIKey:FTHRFSIDBZXSCP-UHFFFAOYSA-N
ID: 126733
SMILES:c1(C(C)C)cc(O)c2c(c1)OC(C)(C)C1C2=CC(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.116
InChIKey:SITGTQNYGOMUGA-UHFFFAOYSA-N
ID: 126734
SMILES:C1CCC(C(O)=O)(C)C2C1(c1c(O)cc(CCCCC)cc1O)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -9.879
InChIKey:PSBWFFQSPREHES-UHFFFAOYSA-N
ID: 126735
SMILES:O(c1cc(C)c2c(c1O)OC(CCC=C(C)CCC=C(C)C)(C)C=C2)N
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -15.681
InChIKey:JIPKSGLKTNCFDT-UHFFFAOYSA-N