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CHEBI:193109 - (6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate

ChEBI IDCHEBI:193109
ChEBI Name(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate
Stars
ASCII Name(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC9H14NO5
Net Charge-1
Average Mass216.213
Monoisotopic Mass216.08775
SMILESCC(C)(CC[C@H]([NH3+])C(=O)[O-])C(=O)C(=O)[O-]
InChIInChI=1S/C9H15NO5/c1-9(2,6(11)8(14)15)4-3-5(10)7(12)13/h5H,3-4,10H2,1-2H3,(H,12,13)(H,14,15)/p-1/t5-/m0/s1
InChIKeyAEFLBEFDGSFJEE-YFKPBYRVSA-M
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate (CHEBI:193109) is a amino acid (CHEBI:33709)
(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate (CHEBI:193109) is a dicarboxylic acid dianion (CHEBI:28965)
(6S)-6-ammonio-3,3-dimethyl-2-oxoheptanedioate (CHEBI:193109) is a oxo carboxylic acid anion (CHEBI:35903)
UniProt Name  Source
(6S)-6-amino-3,3-dimethyl-2-oxoheptanedioateUniProt
Citations