CHEBI:29032 - (R)-pantothenate

ChEBI IDCHEBI:29032
ChEBI Name(R)-pantothenate
Stars
ASCII Name(R)-pantothenate
DefinitionA pantothenate that is the conjugate base of (R)-pantothenic acid, obtained by deprotonation of the carboxy group.
Secondary ChEBI IDsCHEBI:11008, CHEBI:18700
Last Modified22 July 2021
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC9H16NO5
Net Charge-1
Average Mass218.229
Monoisotopic Mass218.10340
SMILESCC(C)(CO)[C@@H](O)C(=O)NCCC(=O)[O-]
InChIInChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/p-1/t7-/m0/s1
InChIKeyGHOKWGTUZJEAQD-ZETCQYMHSA-M
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
algal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
water-soluble vitamin (role)  Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine.
Application:
nutraceutical  A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance.
ChEBI Ontology
Outgoing Relation(s)
(R)-pantothenate (CHEBI:29032) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
(R)-pantothenate (CHEBI:29032) has role plant metabolite (CHEBI:76924)
(R)-pantothenate (CHEBI:29032) is a pantothenate (CHEBI:16454)
(R)-pantothenate (CHEBI:29032) is a vitamin B5 (CHEBI:176840)
(R)-pantothenate (CHEBI:29032) is conjugate base of (R)-pantothenic acid (CHEBI:46905)
Incoming Relation(s)
(R)-pantothenic acid (CHEBI:46905) is conjugate acid of (R)-pantothenate (CHEBI:29032)
IUPAC Name 
3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoate
Synonyms  Source
(R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-β-alanine, ion(1−)ChemIDplus
pantothenateChemIDplus
(R)-PantothenateKEGG COMPOUND
UniProt Name  Source
(R)-pantothenateUniProt
Manual XrefsDatabases
PANTOTHENATEMetaCyc
Registry NumbersSources
Reaxys:3907450Reaxys
Gmelin:775395Gmelin
CAS:20938-62-9ChemIDplus
Citations