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CHEBI:16411 - indole-3-acetic acid

ChEBI IDCHEBI:16411
ChEBI Nameindole-3-acetic acid
Stars
DefinitionA monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by a 1H-indol-3-yl group.
Secondary ChEBI IDsCHEBI:5905, CHEBI:24802
Last Modified13 December 2024
DownloadsMolfile

FormulaC10H9NO2
Net Charge0
Average Mass175.187
Monoisotopic Mass175.06333
SMILESO=C(O)Cc1cnc2ccccc12
InChIInChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)
InChIKeySEOVTRFCIGRIMH-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS90)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification

ChEBI Ontology
IUPAC Name 
1H-indol-3-ylacetic acid
Synonyms  Source
Indole-3-acetic acidKEGG COMPOUND
Indoleacetic acidKEGG COMPOUND
heteroauxinNIST Chemistry WebBook
IAANIST Chemistry WebBook
3-Indolylessigsäure  deChEBI
IES  deChEBI
Manual XrefsDatabases
C00954KEGG COMPOUND
C00954KEGG COMPOUND
Indole-3-acetic_acidWikipedia
DB07950DrugBank
HMDB0000197HMDB
IACPDBeChem
C00000100KNApSAcK
1106BPDB
Registry NumbersSources
Gmelin:143197Gmelin
Reaxys:143358Reaxys
CAS:87-51-4KEGG COMPOUND
CAS:87-51-4ChemIDplus
CAS:87-51-4NIST Chemistry WebBook
Citations