Difference between revisions of "MONOMETHYL-ESTER-OF-TRANS-ACONITATE"

Latest revision as of 20:43, 25 March 2018

Metabolite MONOMETHYL-ESTER-OF-TRANS-ACONITATE

• smiles:
  • COC(=O)C(CC(=O)[O-])=CC(=O)[O-]
• inchi key:
  • InChIKey=BRYKYSQCLNCYQW-DUXPYHPUSA-L
• common name:
  • (E)-3-(methoxycarbonyl)pent-2-enedioate
• molecular weight:
  • 186.121
• Synonym(s):
  • E-3-carboxy-2-pentenedioate 6-methyl ester
  • monomethyl-ester-of-trans-aconitate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

• RXN0-2441

Reaction(s) of unknown directionality

External links

• PUBCHEM:
  • 23615417
• CHEMSPIDER:
  • 19951451
• CHEBI:
  • 57470
• BIGG : aconm
• LIGAND-CPD:
  • C11514