EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:44422 - 2-HYDROXY-2-NITROMETHYL SUCCINIC ACID

Default Structure
ChEBI IDCHEBI:44422
ChEBI Name2-HYDROXY-2-NITROMETHYL SUCCINIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC5H7NO7
Net Charge0
Average Mass193.111
Monoisotopic Mass193.02225
SMILES[H]OC(=O)C([H])([H])[C@](O[H])(C(=O)O[H])C([H])([H])[N+](=O)[O-]
InChIInChI=1S/C5H7NO7/c7-3(8)1-5(11,4(9)10)2-6(12)13/h11H,1-2H2,(H,7,8)(H,9,10)/t5-/m1/s1
InChIKeyMTIGFRIXIPBOPZ-RXMQYKEDSA-N
ChEBI Ontology
Outgoing Relation(s)
2-HYDROXY-2-NITROMETHYL SUCCINIC ACID (CHEBI:44422) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-HYDROXY-2-NITROMETHYL SUCCINIC ACIDPDBeChem
(2R)-2-hydroxy-2-(nitromethyl)butanedioic acidPDBeChem
Manual XrefsDatabases
NTCPDBeChem