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CHEBI:7916 - pantothenic acid

ChEBI IDCHEBI:7916
ChEBI Namepantothenic acid
Stars
DefinitionA member of the class of pantothenic acids that is an amide formed from pantoic acid and β-alanine.
Last Modified18 April 2024
DownloadsMolfile

FormulaC9H17NO5
Net Charge0
Average Mass219.237
Monoisotopic Mass219.11067
SMILESCC(C)(CO)C(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)
InChIKeyGHOKWGTUZJEAQD-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification

ChEBI Ontology
IUPAC Name 
3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoic acid
Synonyms  Source
Pantothenic acidKEGG COMPOUND
N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-β-alanineChEBI
Manual XrefsDatabases
C00864KEGG COMPOUND
D07413KEGG DRUG
DB01783DrugBank
Pantothenic_acidWikipedia
HMDB0000210HMDB
Registry NumbersSources
Reaxys:1727062Reaxys
CAS:599-54-2ChemIDplus
Citations