CHEBI:16454 - pantothenate

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ChEBI Name pantothenate
ChEBI ID CHEBI:16454
Definition A monocarboxylic acid anion that is the conjugate base of pantothenic acid, obtained by deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:14739, CHEBI:25846
Supplier Information ChemicalBook:CB7388480, eMolecules:484930, ZINC000000895042
Download Molfile XML SDF
Formula C9H16NO5
Net Charge -1
Average Mass 218.22700
Monoisotopic Mass 218.10340
InChI InChI=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
InChIKey GHOKWGTUZJEAQD-UHFFFAOYSA-M
SMILES CC(C)(CO)C(O)C(=O)NCCC([O-])=O
Metabolite of Species Details
Chlamydomonas reinhardtii (NCBI:txid3055) See: PubMed
Roles Classification
Biological Role(s): 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pantothenate (CHEBI:16454) has role algal metabolite (CHEBI:84735)
pantothenate (CHEBI:16454) is a monocarboxylic acid anion (CHEBI:35757)
pantothenate (CHEBI:16454) is conjugate base of pantothenic acid (CHEBI:7916)
Incoming (R)-pantothenate (CHEBI:29032) is a pantothenate (CHEBI:16454)
pantothenic acid (CHEBI:7916) is conjugate acid of pantothenate (CHEBI:16454)
IUPAC Name
3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate
Synonyms Sources
N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-β-alaninate ChEBI
pantothenate UniProt
Citation Waiting for Citations Type Source
21463532 PubMed citation Europe PMC
Last Modified
10 June 2015