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carboxyspermidine

PropertiesImage
MNX_IDMNXM741438 Image of MNXM741438
referencechebi:65072
formulaC8H21N3O2
global charge2
mol weight191.275
InChIKeyICLFWLHIBPQMFT-ZETCQYMHSA-P
InChIInChI=1S/C8H19N3O2/c9-4-1-2-5-11-6-3-7(10)8(12)13/h7,11H,1-6,9-10H2,(H,12,13)/p+2/t7-/m0/s1
SMILES[NH3+]CCCC[NH2+]CC[C@H]([NH3+])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C8H19N3O2/c9-4-1-2-5-11-6-3-7(10)8(12)13/h7,11H,1-6,9-10H2,(H,12,13)/t7-/m0/s1 Image of MNXM741438
SMILES (mnx)[CH2:1]([CH2:2][CH2:5][NH:11][CH2:6][CH2:3][C@@H:7]([C:8](=[O:12])[OH:13])[NH2:10])[CH2:4][NH2:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:65072
chebi:65072
ICLFWLHIBPQMFT-ZETCQYMHSA-P 		carboxyspermidine
(2S)-2-ammonio-5-[(3-ammoniopropyl)ammonio]pentanoate
(2S)-2-azaniumyl-5-[(3-azaniumylpropyl)azaniumyl]pentanoate
carboxyspermidine(2+)

kegg.compound:C18172
keggC:C18172
ICLFWLHIBPQMFT-UHFFFAOYSA-N 		Carboxyspermidine
2-Amino-4-[(4-aminobutyl)amino]-butanoic acid

keggC:M_C18172 		secondary/obsolete/fantasy identifier