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 Last Modified 23 October 2015