Terminology Service for NFDI4Health
valerate
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http://purl.obolibrary.org/obo/CHEBI_31011
A short-chain fatty acid anion that is the conjugate base of valeric acid; present in ester form as component of many steroid-based pharmaceuticals.
Term info
Label
valerate
Synonyms
- pentanoate
Subsets
3_STAR
charge
-1
formula
C5H9O2
has alternative id
CHEBI:14751, CHEBI:25890
has obo namespace
chebi_ontology
has related synonym
pentanoic acid, ion(1-), pentanoate, CH3-[CH2]3-COO(-), n-propylacetate
id
CHEBI:31011
inchi
InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/p-1
inchikey
NQPDZGIKBAWPEJ-UHFFFAOYSA-M
mass
101.12376
monoisotopicmass
101.06080
smiles
CCCCC([O-])=O