N-citryl-spermidine zwitterion (CHEBI:149586)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	N-citryl-spermidine zwitterion

ChEBI ID	CHEBI:149586

ChEBI ASCII Name	N-citryl-spermidine zwitterion

Definition	Major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C13H25N3O6

Net Charge

Average Mass

319.358

Monoisotopic Mass

319.17434

InChI

InChI=1S/C13H25N3O6/c14-4-3-6-15-5-1-2-7-16-10(17)8-13(22,12(20)21)9-11(18)19/h15,22H,1-9,14H2,(H,16,17)(H,18,19)(H,20,21)

InChIKey

JJVVKHQEFSESNM-UHFFFAOYSA-N

SMILES

C(=O)([O-])C(CC(=O)NCCCC[NH2+]CCC[NH3+])(CC(=O)[O-])O

ChEBI Ontology
Outgoing	N-citryl-spermidine zwitterion (CHEBI:149586) has functional parent citrate(3−) (CHEBI:16947) N-citryl-spermidine zwitterion (CHEBI:149586) has functional parent spermidine(3+) (CHEBI:57834) N-citryl-spermidine zwitterion (CHEBI:149586) is a zwitterion (CHEBI:27369)

Synonym	Source
N⁸-citryl-spermidine	UniProt

Citation	Type	Source
18758617	PubMed citation	SUBMITTER