aeruginascin(1-) (CHEBI:193060)

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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	aeruginascin(1−)

ChEBI ID	CHEBI:193060

ChEBI ASCII Name	aeruginascin(1-)

Definition	An organophosphate oxoanion resulting from the deprotonation of the phosphate group of aeruginascin; major microspecies 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

C13H18N2O4P

Net Charge

-1

Average Mass

297.271

Monoisotopic Mass

297.10097

InChI

InChI=1S/C13H19N2O4P/c1-15(2,3)8-7-10-9-14-11-5-4-6-12(13(10)11)19-20(16,17)18/h4-6,9,14H,7-8H2,1-3H3,(H-,16,17,18)/p-1

InChIKey

OIIPFLWAQQNCHA-UHFFFAOYSA-M

SMILES

C=1C=CC(=C2C(=CNC12)CC[N+](C)(C)C)OP([O-])(=O)[O-]

ChEBI Ontology
Outgoing	aeruginascin(1−) (CHEBI:193060) is a organophosphate oxoanion (CHEBI:58945) aeruginascin(1−) (CHEBI:193060) is a quaternary ammonium ion (CHEBI:35267)

Synonym	Source
aeruginascin	UniProt

Citation	Type	Source
35583969	PubMed citation	SUBMITTER