mesaconate
Chemical Formula:
C5H4O4
Molecular Weight:
128.084 Daltons
Monoisotopic Mass:
130.026608681 Daltons
SMILES:
CC(C([O-])=O)=CC([O-])=O
InChI:
1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/p-2/b3-2+
InChIKey:
Synonyms
- 2-methylfumarate
- mesaconic acid
- (E)-2-methyl-2-butanedionic acid
Databases
MetaCyc:
MESACONATE
PubChem (CID):
7257940
MetaboLights:
MTBLC36986
HMDB:
HMDB00749
ChEBI:
36986
KEGG:
C01732
CAS:
498-24-8
Seed:
cpd01194
MetaNetX:
MNXM1241