CHEBI:36076 - L-topaquinone

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ChEBI Name L-topaquinone
ChEBI ID CHEBI:36076
ChEBI ASCII Name L-topaquinone
Definition A topaquinone that has S configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C9H9NO5
Net Charge 0
Average Mass 211.17150
Monoisotopic Mass 211.04807
InChI InChI=1S/C9H9NO5/c10-5(9(14)15)1-4-2-7(12)8(13)3-6(4)11/h2-3,5,13H,1,10H2,(H,14,15)/t5-/m0/s1
InChIKey AGMJSPIGDFKRRO-YFKPBYRVSA-N
SMILES N[C@@H](CC1=CC(=O)C(O)=CC1=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing L-topaquinone (CHEBI:36076) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
L-topaquinone (CHEBI:36076) is a topaquinone (CHEBI:36077)
Incoming 3-{(3E)-4-hydroxy-6-oxo-3-[(2-phenylethyl)imino]cyclohexa-1,4-dien-1-yl}-L-alanine (CHEBI:39640) has functional parent L-topaquinone (CHEBI:36076)
L-topaquinone residue (CHEBI:46045) is substituent group from L-topaquinone (CHEBI:36076)
IUPAC Name
(2S)-2-amino-3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoic acid
Synonyms Sources
(S)-α-amino-4-hydroxy-3,6-dioxo-1,4-cyclohexadiene-1-propanoic acid ChemIDplus
6-hydroxydopa quinone ChemIDplus
topa quinone ChemIDplus
topaquinone ChemIDplus
Manual Xref Database
DB04334 DrugBank
View more database links
Registry Number Type Source
64192-68-3 CAS Registry Number ChemIDplus
Last Modified
26 March 2015