CHEBI:10986 - (R)-4'-phosphonatopantothenate(3−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (R)-4'-phosphonatopantothenate(3−)
ChEBI ID CHEBI:10986
ChEBI ASCII Name (R)-4'-phosphonatopantothenate(3-)
Definition An organophosphate oxoanion that is the trianion of (R)-5-phosphopantothenic acid arising from deprotonation of the carboxy and phosphate OH groups; major species at pH 7.3
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C9H15NO8P
Net Charge -3
Average Mass 296.19110
Monoisotopic Mass 296.05517
InChI InChI=1S/C9H18NO8P/c1-9(2,5-18-19(15,16)17)7(13)8(14)10-4-3-6(11)12/h7,13H,3-5H2,1-2H3,(H,10,14)(H,11,12)(H2,15,16,17)/p-3/t7-/m0/s1
InChIKey XHFVGHPGDLDEQO-ZETCQYMHSA-K
SMILES CC(C)(COP([O-])([O-])=O)[C@@H](O)C(=O)NCCC([O-])=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-4'-phosphonatopantothenate(3−) (CHEBI:10986) has functional parent (R)-pantothenic acid (CHEBI:46905)
(R)-4'-phosphonatopantothenate(3−) (CHEBI:10986) has role human metabolite (CHEBI:77746)
(R)-4'-phosphonatopantothenate(3−) (CHEBI:10986) is a organophosphate oxoanion (CHEBI:58945)
(R)-4'-phosphonatopantothenate(3−) (CHEBI:10986) is conjugate base of (R)-4'-phosphopantothenate(2−) (CHEBI:20891)
Incoming (R)-4'-phosphopantothenate(2−) (CHEBI:20891) is conjugate acid of (R)-4'-phosphonatopantothenate(3−) (CHEBI:10986)
IUPAC Name
3-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonatooxy)butanamido]propanoate
Synonym Source
(R)-4'-phosphopantothenate UniProt
Last Modified
10 March 2014