CHEBI:17312 - N¹-acetylspermine

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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 ZINC000003870097 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H28N4O Net Charge 0 Average Mass 244.37708 Monoisotopic Mass 244.22631 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 via 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 Manual Xrefs Databases C02567 KEGG COMPOUND HMDB0001186 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 Types Sources 22959971 PubMed citation Europe PMC 3757213 PubMed citation Europe PMC 4065178 PubMed citation Europe PMC 7260107 PubMed citation Europe PMC Last Modified 23 October 2015