pentanoate

Chemical Formula:

C₅H₉O₂

Molecular Weight:

101.125 Daltons

Monoisotopic Mass:

102.0680795652 Daltons

SMILES:

CCCCC(=O)[O-]

InChI:

1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/p-1

InChIKey:

NQPDZGIKBAWPEJ-UHFFFAOYSA-M

Synonyms

valerianic acid
pentanoic acid
valerate

Databases

MetaCyc: VALERATE

RefMet: Valeric acid

MetaboLights: MTBLC31011

HMDB: HMDB00892

ChemSpider: 102757

PubChem (CID): 114781 7991

ChEBI: 31011

KEGG: C00803

MediaDB: compounds/739/

Seed: cpd00597

MetaNetX: MNXM3382

CAS: 109-52-4