P-[[4-[(1-oxotetradecyl)amino]phenyl]methyl]-phosphonic acid (CHEBI:183946)

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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	P-[[4-[(1-oxotetradecyl)amino]phenyl]methyl]-phosphonic acid

ChEBI ID	CHEBI:183946

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H36NO4P

Net Charge

Average Mass

397.496

Monoisotopic Mass

397.23820

InChI

InChI=1S/C21H36NO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-21(23)22-20-16-14-19(15-17-20)18-27(24,25)26/h14-17H,2-13,18H2,1H3,(H,22,23)(H2,24,25,26)

InChIKey

OUXAHVRWFHOKHY-UHFFFAOYSA-N

SMILES

P(O)(O)(=O)CC1=CC=C(NC(=O)CCCCCCCCCCCCC)C=C1

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in small intestine (BTO:0000651). of strain C57BL/6 Mouse [THESAURUS.OWL#C14424] See: MetaboLights Study
Nippostrongylus brasiliensis (NCBI:txid27835)	Found in Whole Organism (THESAURUS.OWL#C13413). See: MetaboLights Study

ChEBI Ontology
Outgoing	P-[[4-[(1-oxotetradecyl)amino]phenyl]methyl]-phosphonic acid (CHEBI:183946) is a anilide (CHEBI:13248)

IUPAC Name

[4-(tetradecanoylamino)phenyl]methylphosphonic acid