Mid025274: 2-Hydroxy-2,4-pentadienoate
Metabolite Information
Name
2-Hydroxy-2,4-pentadienoate
IUPAC Name
(2E)-1-hydroxy-1-oxopenta-2,4-dien-2-olate
Molecular Formula
C5H6O3
Molecular Weight
113.09
Exact Mass
113.023869
SMILES
C=CC=C(C(=O)O)[O-]
InChIKey
VHTQQDXPNUTMNB-ONEGZZNKSA-M
InChI
InChI=1S/C5H6O3/c1-2-3-4(6)5(7)8/h2-3,6H,1H2,(H,7,8)/p-1/b4-3+
Other Databases Link
kegg_C00596
CID_5280361
CID_5280361
Structure
2D Structure
3D Conformer
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Subclass:
Fatty acids and conjugates
Species containing this metabolite
| Clematis chinensis |
Metabolite Spectrum Accession Label