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(S)-gabaculine

Go to external page http://purl.obolibrary.org/obo/CHEBI_145084

The (S)-enantiomer of gabaculine.

Term info

Label

(S)-gabaculine

Synonyms
  • (5S)-5-aminocyclohexa-1,3-diene-1-carboxylic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
(5S)-5-aminocyclohexa-1,3-diene-1-carboxylic acid [ IUPAC ]

charge

0

formula

C7H9NO2

has obo namespace

chebi_ontology

has related synonym

[S,(-)]-5-amino-1,3-cyclohexadiene-1-carboxylic acid, (-)-5-amino-1,3-cyclohexadiene-1-carboxylic acid, gabaculine, (S)-5-amino-1,3-cyclohexadiene-1-carboxylic acid, (-)-gabaculine, gabaculin

id

CHEBI:145084

inchi

InChI=1S/C7H9NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-3,6H,4,8H2,(H,9,10)/t6-/m1/s1

inchikey

KFNRJXCQEJIBER-ZCFIWIBFSA-N

mass

139.154

monoisotopicmass

139.06333

smiles

C1=C(C[C@@H](C=C1)N)C(O)=O