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N1-acetylspermine (CHEBI:17312)

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ChEBI Name N1-acetylspermine
ChEBI ID CHEBI:17312
ChEBI ASCII Name N(1)-acetylspermine
Definition An acetylspermine carrying an acetyl group at position N1.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:7357, CHEBI:12626, CHEBI:21799
Supplier Information
See structure as:  Image  Applet
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Formula Source
C12H28N4O KEGG COMPOUND
Net Charge 0
Average Mass 244.37708
InChI
InChI=1S/C12H28N4O/c1-12(17)16-11-5-10-15-8-3-2-7-14-9-4-6-13/h14-15H,2-11,13H2,1H3,(H,16,17)
InChIKey
GUNURVWAJRRUAV-UHFFFAOYSA-N
SMILES
CC(=O)NCCCNCCCCNCCCN
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing N1-acetylspermine (CHEBI:17312) has role human metabolite (CHEBI:77746)
N1-acetylspermine (CHEBI:17312) is a acetamides (CHEBI:22160)
N1-acetylspermine (CHEBI:17312) is a acetylspermine (CHEBI:22205)
N1-acetylspermine (CHEBI:17312) is conjugate base of N1-acetylsperminium(3+) (CHEBI:58101)
Incoming N1-acetylsperminium(3+) (CHEBI:58101) is conjugate acid of N1-acetylspermine (CHEBI:17312)
IUPAC Name
N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide
Synonym Source
N1-Acetylspermine KEGG COMPOUND
Database Links Databases
C02567 KEGG COMPOUND
HMDB01186 HMDB
N1-ACETYLSPERMINE MetaCyc
SP5 PDBeChem
View more database links
Registry Numbers Types Sources
25593-72-0 CAS Registry Number ChemIDplus
4180788 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
22959971 PubMed citation CiteXplore
3757213 PubMed citation CiteXplore
4065178 PubMed citation CiteXplore
7260107 PubMed citation CiteXplore
Last Modified
28 July 2014

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