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CHEBI:73670 - cysteine tryptophylquinone

ChEBI IDCHEBI:73670
ChEBI Namecysteine tryptophylquinone
Stars
DefinitionAn L-tryptophan derivative that is L-tryptophan-6,7-dione in which a cysteine unit is attached at position 4 via its side-chain thiol group.
Last Modified6 June 2016
SubmitterSteve
DownloadsMolfile
FormulaC14H15N3O6S
Net Charge0
Average Mass353.356
Monoisotopic Mass353.06816
SMILESN[C@@H](CSC1=CC(=O)C(=O)c2ncc(C[C@H](N)C(=O)O)c21)C(=O)O
InChIInChI=1S/C14H15N3O6S/c15-6(13(20)21)1-5-3-17-11-10(5)9(2-8(18)12(11)19)24-4-7(16)14(22)23/h2-3,6-7,17H,1,4,15-16H2,(H,20,21)(H,22,23)/t6-,7-/m0/s1
InChIKeyXSFUAHVXCRYKEI-BQBZGAKWSA-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)
cysteine tryptophylquinone (CHEBI:73670) is a L-cysteine thioether (CHEBI:27532)
cysteine tryptophylquinone (CHEBI:73670) is a L-tryptophan derivative (CHEBI:47994)
cysteine tryptophylquinone (CHEBI:73670) is a orthoquinones (CHEBI:25622)
Incoming Relation(s)
cysteine tryptophylquinone residue (CHEBI:20252) is substituent group from cysteine tryptophylquinone (CHEBI:73670)
IUPAC Name 
S-{3-[(2S)-2-amino-2-carboxyethyl]-6,7-dioxo-6,7-dihydro-1H-indol-4-yl}-L-cysteine
Synonym  Source
CTQMetaCyc
Manual XrefsDatabases
CPD-12470MetaCyc
Citations