Met002853: 5-Oxopentanoate
Metabolite Information
Name
5-Oxopentanoate
IUPAC Name
5-oxopentanoate
Molecular Formula
C5H8O3
Molecular Weight
115.11
Exact Mass
115.0395191
SMILES
C(CC=O)CC(=O)[O-]
InChIKey
VBKPPDYGFUZOAJ-UHFFFAOYSA-M
InChI
InChI=1S/C5H8O3/c6-4-2-1-3-5(7)8/h4H,1-3H2,(H,7,8)/p-1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Subclass:
Fatty acids and conjugates
Crops containing this metabolite
cassava
Metabolite Spectrum Accession Label