CHEBI:43012 - phenyl [1-(N-succinylamino)pentyl]phosphonate

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ChEBI Name phenyl [1-(N-succinylamino)pentyl]phosphonate
ChEBI ID CHEBI:43012
ChEBI ASCII Name phenyl [1-(N-succinylamino)pentyl]phosphonate
Definition A dicarboxylic acid monoamide that is a hapten and transition state analogue containing phenylphosphonate and succinoylamino moieties.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C15H22NO6P
Net Charge 0
Average Mass 343.31200
Monoisotopic Mass 343.11847
InChI InChI=1S/C15H22NO6P/c1-2-3-9-14(16-13(17)10-11-15(18)19)23(20,21)22-12-7-5-4-6-8-12/h4-8,14H,2-3,9-11H2,1H3,(H,16,17)(H,18,19)(H,20,21)/t14-/m1/s1
InChIKey FJQWWGCHPFSERW-CQSZACIVSA-N
SMILES CCCC[C@H](NC(=O)CCC(O)=O)[P@](O)(=O)Oc1ccccc1
Roles Classification
Biological Role(s): hapten
Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
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ChEBI Ontology
Outgoing phenyl [1-(N-succinylamino)pentyl]phosphonate (CHEBI:43012) has functional parent succinic acid (CHEBI:15741)
phenyl [1-(N-succinylamino)pentyl]phosphonate (CHEBI:43012) has role hapten (CHEBI:59174)
phenyl [1-(N-succinylamino)pentyl]phosphonate (CHEBI:43012) is a dicarboxylic acid monoamide (CHEBI:35735)
phenyl [1-(N-succinylamino)pentyl]phosphonate (CHEBI:43012) is a organic phosphonate (CHEBI:37592)
IUPAC Name
4-({(1R)-1-[(R)-hydroxy(phenoxy)phosphoryl]pentyl}amino)-4-oxobutanoic acid
Synonym Source
phenyl[1-(n-succinylamino)pentyl]phosphonate ChEBI
Manual Xrefs Databases
1A0Q PDB
1EAP PDB
DB07893 DrugBank
HEP PDBeChem
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Last Modified
25 January 2017