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N(1)-acetylspermine

Properties

Image

Occurences in reactions

MNX_ID

MNXM600

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	12

formula

C₁₂H₃₁N₄O

charge

mass

247.24814

reference

InChIKey

GUNURVWAJRRUAV-UHFFFAOYSA-Q

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)/p+3

SMILES

CC(=O)NCCC[NH2+]CCCC[NH2+]CCC[NH3+]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58101 chebi:58101	N(1)-acetylspermine N(1)-acetylsperminium trication N(1)-acetylsperminium(3+) N-(3-acetamidopropyl)-N'-(3-azaniumylpropyl)butane-1,4-diaminium
reactome:R-ALL-141323 reactomeM:R-ALL-141323 reactome:R-ALL-353575 reactomeM:R-ALL-353575 CHEBI:17312 chebi:17312	N(1)-acetylspermine N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide N1-Acetylspermine
hmdb:HMDB0062644	N(1)-acetylsperminium(3+) N(1)-Acetylspermine N(1)-Acetylsperminium trication {4-[(3-ammoniopropyl)ammonio]butyl}({3-[(1-hydroxyethylidene)amino]propyl})azanium {4-[(3-azaniumylpropyl)azaniumyl]butyl}({3-[(1-hydroxyethylidene)amino]propyl})azanium
bigg.metabolite:N1sprm biggM:N1sprm	N1 Acetylspermine
kegg.compound:C02567 keggC:C02567	N1-Acetylspermine
hmdb:HMDB0001186	N1-Acetylspermine Monoacetylspermine N'-acetylspermine N'-monoacetylspermine N(1)-Acetylspermine N(1)-acetylspermine N-(3-((4-((3-Aminopropyl)amino)butyl)amino)propyl)-acetamide N-Acetylspermine N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamide N1-Monoacetylspermine
sabiork.compound:6265 sabiorkM:6265	N1-Acetylspermine N-Acetylspermine
seed.compound:cpd01680 seedM:cpd01680	N1-Acetylspermine N1-acetylspermine N1sprm
metacyc.compound:N1-ACETYLSPERMINE metacycM:N1-ACETYLSPERMINE	N1-acetylspermine
hmdb:HMDB01186 hmdb:HMDB62644 chebi:12626 chebi:21799 chebi:7357 biggM:M_N1sprm keggC:M_C02567 seedM:M_cpd01680	secondary/obsolete/fantasy identifier