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CHEBI:131783 - indolmycenate

ChEBI IDCHEBI:131783
ChEBI Nameindolmycenate
Stars
DefinitionA (2S)-2-hydroxy monocarboxylic acid anion that is the conjugate base of indolmycenic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified2 December 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H12NO3
Net Charge-1
Average Mass218.232
Monoisotopic Mass218.08227
SMILESC[C@H](c1cnc2ccccc12)[C@H](O)C(=O)[O-]
InChIInChI=1S/C12H13NO3/c1-7(11(14)12(15)16)9-6-13-10-5-3-2-4-8(9)10/h2-7,11,13-14H,1H3,(H,15,16)/p-1/t7-,11+/m1/s1
InChIKeyNUFXPJOTSOMKFZ-HQJQHLMTSA-M
ChEBI Ontology
Outgoing Relation(s)
indolmycenate (CHEBI:131783) is a (2S)-2-hydroxy monocarboxylic acid anion (CHEBI:58123)
indolmycenate (CHEBI:131783) is conjugate base of indolmycenic acid (CHEBI:132117)
Incoming Relation(s)
indolmycenic acid (CHEBI:132117) is conjugate acid of indolmycenate (CHEBI:131783)
IUPAC Name 
(2S,3R)-2-hydroxy-3-(1H-indol-3-yl)butanoate
Synonym  Source
(2S,3R)-2-hydroxy-3-(indol-3-yl)butanoateSUBMITTER
UniProt Name  Source
(2S,3R)-2-hydroxy-3-(indol-3-yl)butanoateUniProt
Manual XrefsDatabases
CPD-18934MetaCyc
Citations