EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:143280 - N-[4-(indol-3-yl)butanoyl]-L-cysteinate

ChEBI IDCHEBI:143280
ChEBI NameN-[4-(indol-3-yl)butanoyl]-L-cysteinate
Stars
ASCII NameN-[4-(indol-3-yl)butanoyl]-L-cysteinate
DefinitionAn N-acyl-L-α-amino acid anion resulting from the deprotonation of the carboxy group of N-[4-(indol-3-yl)butanoyl]-L-cysteine. The major species at pH 7.3.
Last Modified6 November 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC15H17N2O3S
Net Charge-1
Average Mass305.379
Monoisotopic Mass305.09654
SMILESO=C(CCCc1cnc2ccccc12)N[C@@H](CS)C(=O)[O-]
InChIInChI=1S/C15H18N2O3S/c18-14(17-13(9-21)15(19)20)7-3-4-10-8-16-12-6-2-1-5-11(10)12/h1-2,5-6,8,13,16,21H,3-4,7,9H2,(H,17,18)(H,19,20)/p-1/t13-/m0/s1
InChIKeyLXMVSQPUILWDOQ-ZDUSSCGKSA-M
ChEBI Ontology
Outgoing Relation(s)
N-[4-(indol-3-yl)butanoyl]-L-cysteinate (CHEBI:143280) is a N-acyl-L-α-amino acid anion (CHEBI:59874)
N-[4-(indol-3-yl)butanoyl]-L-cysteinate (CHEBI:143280) is conjugate base of N-[4-(indol-3-yl)butanoyl]-L-cysteine (CHEBI:145322)
Incoming Relation(s)
N-[4-(indol-3-yl)butanoyl]-L-cysteine (CHEBI:145322) is conjugate acid of N-[4-(indol-3-yl)butanoyl]-L-cysteinate (CHEBI:143280)
IUPAC Name 
N-[4-(1H-indol-3-yl)butanoyl]-L-cysteinate
UniProt Name  Source
(indol-3-yl)butanoyl-L-cysteineUniProt
Citations