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CHEBI:136930 - 1-(2-oxindole-3-acetyl)-β-D-glucose

ChEBI IDCHEBI:136930
ChEBI Name1-(2-oxindole-3-acetyl)-β-D-glucose
Stars
ASCII Name1-(2-oxindole-3-acetyl)-beta-D-glucose
DefinitionAn O-acyl carbohydrate obtained by formal condensation of the carboxy group of 2-oxindole-3-acetic acid with the anomeric hydroxy group of β-D-glucose.
Last Modified18 April 2018
Submittermwilliams
DownloadsMolfile
FormulaC16H19NO8
Net Charge0
Average Mass353.327
Monoisotopic Mass353.11107
SMILESO=C(CC1C(=O)Nc2ccccc21)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C16H19NO8/c18-6-10-12(20)13(21)14(22)16(24-10)25-11(19)5-8-7-3-1-2-4-9(7)17-15(8)23/h1-4,8,10,12-14,16,18,20-22H,5-6H2,(H,17,23)/t8?,10-,12-,13+,14-,16+/m1/s1
InChIKeyMLVJTFNIARPUAO-LCNORDJOSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702)
- MetaboLights (MTBLS272)
- PubMed (27656890)
Roles Classification
Biological Role:
Arabidopsis thaliana metabolite  Any plant metabolite that is produced by Arabidopsis thaliana.
ChEBI Ontology
Outgoing Relation(s)
1-(2-oxindole-3-acetyl)-β-D-glucose (CHEBI:136930) has functional parent 2-oxindole-3-acetic acid (CHEBI:133221)
1-(2-oxindole-3-acetyl)-β-D-glucose (CHEBI:136930) has role Arabidopsis thaliana metabolite (CHEBI:140602)
1-(2-oxindole-3-acetyl)-β-D-glucose (CHEBI:136930) is a O-acyl carbohydrate (CHEBI:52782)
1-(2-oxindole-3-acetyl)-β-D-glucose (CHEBI:136930) is a oxindoles (CHEBI:38459)
1-(2-oxindole-3-acetyl)-β-D-glucose (CHEBI:136930) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
1-O-[(2-oxo-2,3-dihydro-1H-indol-3-yl)acetyl]-β-D-glucopyranose
Synonyms  Source
2-oxindole-3-acetyl-β-D-glucoseMetaCyc
1-(2-oxindol-3-ylacetyl)-β-D-glucoseChEBI
Manual XrefsDatabases
CPD-9592MetaCyc
Registry NumbersSources
Reaxys:11077869Reaxys