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CHEBI:60858 - (1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid

ChEBI IDCHEBI:60858
ChEBI Name(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid
Stars
ASCII Name(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid
DefinitionA 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid in which stereocentre attached to the carboxylic acid group has S-configuration, while that attached to the amino group has R-configuration.
Last Modified24 December 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC7H9NO3
Net Charge0
Average Mass155.153
Monoisotopic Mass155.05824
SMILESN[C@H]1C(=O)CC=C[C@@H]1C(=O)O
InChIInChI=1S/C7H9NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-2,4,6H,3,8H2,(H,10,11)/t4-,6+/m0/s1
InChIKeyAQGCSVBPRRQXIN-UJURSFKZSA-N
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)
(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858) is a 6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60854)
(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858) is enantiomer of (1R,6S)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60857)
(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858) is tautomer of (1S,6R)-6-ammonio-5-oxocyclohex-2-ene-1-carboxylate (CHEBI:60863)
Incoming Relation(s)
trans-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60866) has part (1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858)
(1R,6S)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60857) is enantiomer of (1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858)
(1S,6R)-6-ammonio-5-oxocyclohex-2-ene-1-carboxylate (CHEBI:60863) is tautomer of (1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid (CHEBI:60858)
IUPAC Name 
(1S,6R)-6-amino-5-oxocyclohex-2-ene-1-carboxylic acid