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

General Information of Drug (ID: DR2493)
Drug Name
Perindopril erbumine
Synonyms
Perindopril (erbumine); Perindopril erbumine [USAN]; Perindopril tert-butylamine; S-9490-3; (2S,3aS,7aS)-1-((S)-N-((S)-1-Carboxybutyl)alanyl)hexahydro-2-indolinecarboxylic acid, 1-ethyl ester, compound with tert-butylamine (1:1); Covapril; Coversyl; McN-A-2833-109; PERINDOPRIL ERBUMINE; (2S,3aS,7aS)-1-[(2S)-2-[[(1S)-1-(ethoxycarbonyl)butyl]amino]-1-oxopropyl]octahydro-1H-indole-2-carboxylic acid tert-butylamine salt; 107133-36-8; 1964X464OJ; ACEON; CHEBI:8025; UNII-1964X464OJ
Indication Essential hypertension [ICD11: BA00] Approved [1]
Structure
3D MOL is unavailable 2D MOL
Pharmaceutical Properties Molecular Weight 441.6 Topological Polar Surface Area 122
Heavy Atom Count 31 Rotatable Bond Count 9
Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 7
Cross-matching ID
PubChem CID
441313
ChEBI ID
CHEBI:8025
CAS Number
107133-36-8
Formula
C23H43N3O5
Canonical SMILES
CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O.CC(C)(C)N
InChI
1S/C19H32N2O5.C4H11N/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24;1-4(2,3)5/h12-16,20H,4-11H2,1-3H3,(H,23,24);5H2,1-3H3/t12-,13-,14-,15-,16-;/m0./s1
InChIKey
IYNMDWMQHSMDDE-MHXJNQAMSA-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
Perindopril DM001212
107807
Hydrolysis - Hydrolysis 1 [3]
Perindopril Acyl-beta-D-glucuronide DM001217
45040207
Conjugation - Glucuronidation 2 [3]
Perindopril lactam DM001218 N. A. Unclear 2 [4]
Perindoprilat DM001213
72022
Unclear 2 [3]
Perindoprilat glucuronide DM001214
179962
Conjugation - Glucuronidation 3 [3]
Perindoprilat Lactam A DM001215
68524696
Unclear 3 [3]
Perindoprilat Lactam B DM001216
59253360
Unclear 3 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR002001 Perindopril erbumine Perindopril Hydrolysis - Hydrolysis Unclear [3]
MR001995 Perindopril Perindoprilat Unclear Unclear [3]
MR001996 Perindopril Perindopril Acyl-beta-D-glucuronide Conjugation - Glucuronidation Unclear [3]
MR001997 Perindopril Perindopril lactam Unclear Unclear [4]
MR001998 Perindoprilat Perindoprilat glucuronide Conjugation - Glucuronidation Unclear [3]
MR001999 Perindoprilat Perindoprilat Lactam A Unclear Unclear [3]
MR002000 Perindoprilat Perindoprilat Lactam B Unclear Unclear [3]
⏷ Show the Full List of 7 MR(s)
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Unclear metabolic mechanism (DME-unclear) DME1365 Bacteroides dorei Not Available Not Available [2]
Unclear metabolic mechanism (DME-unclear) DME1402 Clostridium botulinum Not Available Not Available [2]
References
1 Perindopril erbumine was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Mapping human microbiome drug metabolism by gut bacteria and their genes. Nature. 2019 Jun;570(7762):462-467.
3 DrugBank(Pharmacology-Metabolism)Perindopril erbumine
4 U. S. FDA Label -Perindopril erbumine

If you find any error in data or bug in web service, please kindly report it to Dr. Yin and Dr. Li.