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CHEBI:17990 - 1-O-(indol-3-ylacetyl)-β-D-glucose

ChEBI IDCHEBI:17990
ChEBI Name1-O-(indol-3-ylacetyl)-β-D-glucose
Stars
ASCII Name1-O-(indol-3-ylacetyl)-beta-D-glucose
Secondary ChEBI IDsCHEBI:5906, CHEBI:5907, CHEBI:14448, CHEBI:14449, CHEBI:17758, CHEBI:18978, CHEBI:24805
Last Modified7 July 2015
DownloadsMolfile
FormulaC16H19NO7
Net Charge0
Average Mass337.328
Monoisotopic Mass337.11615
SMILESO=C(Cc1cnc2ccccc12)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C16H19NO7/c18-7-11-13(20)14(21)15(22)16(23-11)24-12(19)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-18,20-22H,5,7H2/t11-,13-,14+,15-,16+/m1/s1
InChIKeyHHDMMUWDSFASNB-JZYAIQKZSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
1-O-(indol-3-ylacetyl)-β-D-glucose (CHEBI:17990) has functional parent β-D-glucose (CHEBI:15903)
1-O-(indol-3-ylacetyl)-β-D-glucose (CHEBI:17990) is a indoleacetic acid ester conjugate (CHEBI:64633)
1-O-(indol-3-ylacetyl)-β-D-glucose (CHEBI:17990) is a indolyl carbohydrate (CHEBI:24821)
IUPAC Name 
1-O-(1H-indol-3-ylacetyl)-β-D-glucopyranose
Synonyms  Source
Indole-3-acetyl-beta-1-D-glucoseKEGG COMPOUND
Indole-3-acetyl-beta-1-D-glucosideKEGG COMPOUND
1-O-(indole-3-acetyl)-beta-1-D-glucoseChEBI
β-D-glucopyranose, 1-(1H-indole-3-acetate)ChemIDplus
indole-3-acetic acid β-D-glucosideChEBI
1-O-Indol-3-ylacetylglucoseChemIDplus
UniProt Name  Source
1-O-(indol-3-ylacetyl)-β-D-glucoseUniProt
Manual XrefsDatabases
C04197KEGG COMPOUND
Registry NumbersSources
Beilstein:496559Beilstein
CAS:19817-95-9ChemIDplus