ID | C0051 |
Compound name | Aconitic acid |
Stereochemistry | cis-Aconitic acid |
Aracyc name | cis-Aconitate |
External link | http://pmn.plantcyc.org/ARA/NEW-IMAGE?type=COMPOUND&object=CIS-ACONITATE |
Mass information |
1st experiment : 2nd experiment : GC-TOF/MS, CE-TOF/MS (Anion analysis) |
Molecular Formula | H3C6O6 |
Canonical SMILES | C(=CC(=O)[O-])(C([O-])=O)CC(=O)[O-] |
Molecular Weight | 174.11 |
Pathway Information | glutamine biosynthesis III, TCA cycle variation V (plant), glyoxylate cycle, TCA cycle variation III (eukaryotic) |
CAS ID | 585-84-2 |
Synonym | achilleic acid; equisetic acid; citridinic acid; pyrocitric acid; cis-propene-1,2,3-tricarboxylic acid |
External ID | LIGAND-CPD:C00417, CHEBI:16383, PUBCHEM:5459816, KNAPSACK:C00001177 |