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

General Information of Drug (ID: DR1790)
Drug Name
Putrescine
Synonyms
Butylenediamine; Diaminobutane dihydrochloride; KIDHWZJUCRJVML-UHFFFAOYSA-N; Putrescin; Putreszin; Tetramethyldiamine; Tetramethylendiamin; V10TVZ52E4; butane-1,4-diamine; putrescina; putrescine; tetramethylenediamine; 1,4-Butylenediamine; 1,4-Diamino-n-butane; 1,4-Diaminobutane, 99%; 1,4-Tetramethylenediamine; 1,4-butanediamine; 1,4-butanediammonium; 1,4-diaminobutane; 110-60-1; AI3-25444; BRN 0605282; CCRIS 6751; CHEBI:17148; CHEMBL46257; EINECS 203-782-3; H2N(CH2)4NH2; HSDB 7865; MFCD00008235; NSC 60545; PUT; UNII-V10TVZ52E4
Indication Gastritis [ICD11: DA42] Discontinued [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 88.15 Topological Polar Surface Area 52
Heavy Atom Count 6 Rotatable Bond Count 3
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
1045
PubChem SID
3434 ; 5825 ; 108539 ; 588366 ; 629781 ; 826882 ; 838778 ; 3132664 ; 7437577 ; 7890110 ; 8143681 ; 8150940 ; 10503860 ; 11111663 ; 11335891 ; 11361130 ; 11364540 ; 11367102 ; 11369664 ; 11372474 ; 11374072 ; 11377826 ; 11408821 ; 11462102 ; 11485705 ; 11489751 ; 11491013 ; 11492052 ; 11495460 ; 11537956 ; 15194199 ; 17436306 ; 24859702 ; 24859703 ; 24893255 ; 26702290 ; 26707434 ; 35229592 ; 38337057 ; 46261202 ; 46391410 ; 46392188 ; 46392191 ; 46506728 ; 47662300 ; 47959763 ; 48259246 ; 48259247 ; 49748476 ; 49895575
ChEBI ID
CHEBI:17148
CAS Number
110-60-1
TTD Drug ID
D00FMV
Formula
C4H12N2
Canonical SMILES
C(CCN)CN
InChI
1S/C4H12N2/c5-3-1-2-4-6/h1-6H2
InChIKey
KIDHWZJUCRJVML-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 1 [3]
SPD DM001721
1102
Other reaction - N-Decarboxylation 1 [3]
Spermine DM001722
1103
Other reaction - Decarboxylation 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR007653 Putrescine Spermine Other reaction - Decarboxylation Unclear [3]
MR007654 Putrescine Spermidine Other reaction - N-Decarboxylation Unclear [3]
MR007655 Putrescine -aminobutyric acid Unclear AOC1 ... [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Amiloride-sensitive amine oxidase (AOC1) DME0404 Homo sapiens
AOC1_HUMAN
1.4.3.22
[2]
References
1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800013366)
2 Putrescine metabolism and the study of diamine oxidase activity in vivo. Agents Actions. 1981 Apr;11(1-2):20-7.
3 Human aldehyde dehydrogenase: metabolism of putrescine and histamine

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