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CHEBI:18127 - cadaverine

ChEBI IDCHEBI:18127
ChEBI Namecadaverine
Stars
DefinitionAn alkane-α,ω-diamine comprising a straight-chain pentane core with amino substitutents at positions 1 and 5. A colourless syrupy liquid diamine with a distinctive unpleasant odour, it is a homologue of putresceine and is formed by the bacterial decarboxylation of lysine that occurs during protein hydrolysis during putrefaction of animal tissue. It is also found in plants such as soyabean.
Secondary ChEBI IDsCHEBI:3288, CHEBI:13928, CHEBI:22974, CHEBI:44370
Last Modified6 July 2021
DownloadsMolfile
FormulaC5H14N2
Net Charge0
Average Mass102.181
Monoisotopic Mass102.11570
SMILESNCCCCCN
InChIInChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
InChIKeyVHRGRCVQAFMJIZ-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Daphnia magna (ncbitaxon:35525) - PubMed (20117838)
Glycine max (ncbitaxon:3847) - PubMed (16668466)
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Daphnia magna metabolite  A Daphnia metabolite produced by the species Daphnia magna.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
cadaverine (CHEBI:18127) has role Daphnia magna metabolite (CHEBI:83056)
cadaverine (CHEBI:18127) has role Escherichia coli metabolite (CHEBI:76971)
cadaverine (CHEBI:18127) has role mouse metabolite (CHEBI:75771)
cadaverine (CHEBI:18127) has role plant metabolite (CHEBI:76924)
cadaverine (CHEBI:18127) is a alkane-α,ω-diamine (CHEBI:35411)
cadaverine (CHEBI:18127) is conjugate base of cadaverine(2+) (CHEBI:58384)
Incoming Relation(s)
N-acetylcadaverine (CHEBI:88824) has functional parent cadaverine (CHEBI:18127)
N-substituted cadaverine (CHEBI:50442) has functional parent cadaverine (CHEBI:18127)
monodansylcadaverine (CHEBI:52007) has functional parent cadaverine (CHEBI:18127)
pentamethonium (CHEBI:166825) has functional parent cadaverine (CHEBI:18127)
cadaverine(2+) (CHEBI:58384) is conjugate acid of cadaverine (CHEBI:18127)
IUPAC Name 
pentane-1,5-diamine
Synonyms  Source
CadaverineKEGG COMPOUND
1,5-PentanediamineKEGG COMPOUND
1,5-DiaminopentaneKEGG COMPOUND
PentamethylenediamineKEGG COMPOUND
PENTANE-1,5-DIAMINEPDBeChem
1,5-pentamethylenediamineNIST Chemistry WebBook
Manual XrefsDatabases
C01672KEGG COMPOUND
N2PPDBeChem
CadaverineWikipedia
HMDB0002322HMDB
CADAVERINEMetaCyc
DB03854DrugBank
C00001403KNApSAcK
Registry NumbersSources
Gmelin:2310Gmelin
Reaxys:1697256Reaxys
CAS:462-94-2KEGG COMPOUND
CAS:462-94-2ChemIDplus
CAS:462-94-2NIST Chemistry WebBook
Citations