Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR5442)
Drug Name
Gamma hydroxybutyric acid
Synonyms
Anetamin; GHB; Hydroxyb; Oxybate; SHB; Somsanit; Xyrem; Gamma OH; Oxybate sodium; Utyric acid monosodium salt; EB 27; WY 3478; Gam-OH; Gamma-Hydroxy butyrate; Gamma-Hydroxy sodium butyrate; Gamma-Hydroxybutanoic acid; Gamma-Hydroxybutyrate sodium; Gamma-Hydroxybutyric acid; Gamma-Hydroxybutyric acid decomposition product; Gamma-Hydroxybutyric acid monosodium salt; Gamma-OH; Xyrem (TN); Gamma-Hydroxybutyric acid, sodium salt; Oxy-n-butyric acid; Sodium Oxybate (4-hydroxybutanoic acid); Sodium .gamma.-hydroxybutyrate; Sodium .gamma.-oxybutyrate; AA3E2AF0-AB7A-4A1E-A391-199C049D7162; Butanoic acid, 4-hydroxy-, monosodium salt; Butanoic acid, 4-hydroxy-, sodium salt; Butyric acid, 4-hydroxy-, monosodium salt; Butyric acid, 4-hydroxy-, sodium salt; 3-carboxypropoxy acid; 4 HB; 4-Hydroxy; 4-Hydroxyacid; 4-Hydroxyalkanoic acid; 4-Hydroxybutanoic acid; 4-Hydroxybuttersaeure; 4-Hydroxybutyrate sodium; 4-Hydroxybutyric acid; 4-Hydroxybutyric acid monosodium salt; 4-Hydroxycarboxylic acid; 4-OHB; 4-hydroxy-butyric acid
Indication Narcolepsy [ICD11: 7A20] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 104.1 Topological Polar Surface Area 57.5
Heavy Atom Count 7 Rotatable Bond Count 3
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
10413
ChEBI ID
CHEBI:30830
CAS Number
591-81-1
TTD Drug ID
D0EP8X
Formula
C4H8O3
Canonical SMILES
C(CC(=O)O)CO
InChI
InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7)
InChIKey
SJZRECIVHVDYJC-UHFFFAOYSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
#NAME? DM000332
119
Unclear - Unclear 1 [2]
Succinic Semialdehyde DM006354
1112
Unclear - Unclear 1 [2]
Glutamate DM000317
33032
Unclear - Unclear 2 [2]
Succinate DM003439
160419
Unclear - Unclear 2 [2]
Alpha-ketoglutarate DM000323
164533
Unclear - Unclear 3 [2]
Succinyl-coA DM003438
92133
Unclear - Unclear 3 [2]
Isocitrate DM003436
1198
Unclear - Unclear 4 [2]
Succinyicamitine DM016316
71464481
Unclear - Unclear 4 [2]
Succinyl-coA DM003438
92133
Unclear - Unclear 4 [2]
Glyoxylate DM003099
3614358
Unclear - Unclear 5 [2]
Succinyicamitine DM016316
71464481
Unclear - Unclear 5 [2]
Glycolate DM006516
757
Unclear - Unclear 6 [2]
⏷ Show the Full List of 12  DM(s)
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR012760 Gamma hydroxybutyric acid GABA Unclear - Unclear Unclear [2]
MR012768 Gamma hydroxybutyric acid Succinic semialdehyde Unclear - Unclear Unclear [2]
MR012761 GABA Glutamate Unclear - Unclear Unclear [2]
MR012769 Succinic semialdehyde Succinate Unclear - Unclear Unclear [2]
MR012762 Glutamate Alpha-ketoglutarate Unclear - Unclear Unclear [2]
MR012770 Succinate Succinyl-coA Unclear - Unclear Unclear [2]
MR012763 Alpha-ketoglutarate Isocitrate Unclear - Unclear Unclear [2]
MR012766 Alpha-ketoglutarate Succinyl-coA Unclear - Unclear Unclear [2]
MR012764 Isocitrate Glyoxylate Unclear - Unclear Unclear [2]
MR012767 Succinyl-coA Succinyicamitine Unclear - Unclear Unclear [2]
MR012765 Glyoxylate Glycolate Unclear - Unclear Unclear [2]
⏷ Show the Full List of 11 MR(s)
References
1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 4711).
2 U. S. FDA Label -Gamma hydroxybutyric acid

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