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CHEBI:24814 - indole-3-methanol

ChEBI IDCHEBI:24814
ChEBI Nameindole-3-methanol
Stars
DefinitionAn indolyl alcohol carrying a hydroxymethyl group at position 3. It is a constituent of the cruciferous vegetables and had anticancer activity.
Last Modified24 February 2016
DownloadsMolfile
FormulaC9H9NO
Net Charge0
Average Mass147.177
Monoisotopic Mass147.06841
SMILESOCc1cnc2ccccc12
InChIInChI=1S/C9H9NO/c11-6-7-5-10-9-4-2-1-3-8(7)9/h1-5,10-11H,6H2
InChIKeyIVYPNXXAYMYVSP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
indole-3-methanol (CHEBI:24814) has role antineoplastic agent (CHEBI:35610)
indole-3-methanol (CHEBI:24814) has role plant metabolite (CHEBI:76924)
indole-3-methanol (CHEBI:24814) is a indolyl alcohol (CHEBI:38467)
Incoming Relation(s)
γGluCys(4MeOI3M)Gly (CHEBI:65007) has functional parent indole-3-methanol (CHEBI:24814)
IUPAC Name 
1H-indol-3-ylmethanol
Synonyms  Source
indole-3-carbinolChemIDplus
3-hydroxymethylindoleChemIDplus
3-indolylcarbinolChemIDplus
indole-3-methanolChemIDplus
Manual XrefsDatabases
HMDB0005785HMDB
Indole-3-carbinolWikipedia
LSM-2011LINCS
Registry NumbersSources
Gmelin:1603301Gmelin
Reaxys:121323Reaxys
CAS:700-06-1ChemIDplus
Citations