CHEBI:19418 - 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−)
ChEBI ID CHEBI:19418
ChEBI ASCII Name 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2-)
Definition A dicarboxylic acid dianion obtained by removal of a proton from both of the carboxylic acid groups of 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C8H9NO6
Net Charge -2
Average Mass 215.16020
Monoisotopic Mass 215.04408
InChI InChI=1S/C8H11NO6/c1-4(11)9-2-5(7(12)13)6(3-10)8(14)15/h2,6,10H,3H2,1H3,(H,9,11)(H,12,13)(H,14,15)/p-2
InChIKey BHXUWJPOOLFBAP-UHFFFAOYSA-L
SMILES CC(=O)NC=C(C(CO)C([O-])=O)C([O-])=O
ChEBI Ontology
Outgoing 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−) (CHEBI:19418) has functional parent succinate(2−) (CHEBI:30031)
3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−) (CHEBI:19418) is a dicarboxylic acid dianion (CHEBI:28965)
3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−) (CHEBI:19418) is conjugate base of 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid (CHEBI:16216)
Incoming 3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid (CHEBI:16216) is conjugate acid of 3-(acetamidomethylene)-2-(hydroxymethyl)succinate(2−) (CHEBI:19418)
IUPAC Name
2-(acetamidomethylene)-3-(hydroxymethyl)butanedioate
Synonyms Sources
2-(acetamidomethylene)-3-(hydroxymethyl)succinate UniProt
2-(hydroxymethyl)-3-(acetamidomethylene)succinate ChEBI
Last Modified
28 February 2018