CHEBI:229577 - N1-[(S)-3-amino-3-carboxypropyl]agmatine(2+)

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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 N1-[(S)-3-amino-3-carboxypropyl]agmatine(2+)
ChEBI ID CHEBI:229577
ChEBI ASCII Name N(1)-[(S)-3-amino-3-carboxypropyl]agmatine(2+)
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C9H23N5O2
Net Charge +2
Average Mass 233.315
Monoisotopic Mass 233.18408
InChI InChI=1S/C9H21N5O2/c10-7(8(15)16)3-6-13-4-1-2-5-14-9(11)12/h7,13H,1-6,10H2,(H,15,16)(H4,11,12,14)/p+2/t7-/m0/s1
InChIKey QFUFHOKZTAVOFF-ZETCQYMHSA-P
SMILES C(NC(N)=[NH2+])CCC[NH2+]CC[C@H]([NH3+])C([O-])=O
ChEBI Ontology
Outgoing N1-[(S)-3-amino-3-carboxypropyl]agmatine(2+) (CHEBI:229577) is a guanidinium ion (CHEBI:60251)
Synonyms Sources
carboxyaminopropylagmatine SUBMITTER
N1-[(S)-3-amino-3-carboxypropyl]agmatine UniProt
Manual Xref Database
CPD2PN3-12 MetaCyc accession
View more database links
Citation Waiting for Citations Type Source
37878710 PubMed citation SUBMITTER