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CHEBI:28071 - (indol-3-ylacetyl)-myo-inositol 3-L-arabinoside

ChEBI IDCHEBI:28071
ChEBI Name(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside
Stars
ASCII Name(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside
Secondary ChEBI IDsCHEBI:5911, CHEBI:14441, CHEBI:14442, CHEBI:19426, CHEBI:24818
Last Modified28 November 2019
DownloadsMolfile
FormulaC21H27NO11
Net Charge0
Average Mass469.443
Monoisotopic Mass469.15841
SMILESO=C(Cc1cnc2ccccc12)O[C@H]1[C@@H](O)[C@@H](O)[C@H](O[C@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C21H27NO11/c23-11-7-31-21(18(30)13(11)25)33-20-16(28)14(26)19(15(27)17(20)29)32-12(24)5-8-6-22-10-4-2-1-3-9(8)10/h1-4,6,11,13-23,25-30H,5,7H2/t11-,13-,14-,15-,16-,17+,18+,19+,20+,21+/m0/s1
InChIKeyRBVNENAKUTUHCM-JLJUYRCPSA-N
ChEBI Ontology
Outgoing Relation(s)
(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside (CHEBI:28071) has functional parent myo-inositol (CHEBI:17268)
(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside (CHEBI:28071) is a arabinoside (CHEBI:22601)
(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside (CHEBI:28071) is a indolyl carbohydrate (CHEBI:24821)
(indol-3-ylacetyl)-myo-inositol 3-L-arabinoside (CHEBI:28071) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name 
(1S,2S,3R,4S,5S,6S)-4-(β-L-arabinopyranosyloxy)-2,3,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate
Synonym  Source
Indole-3-ylacetyl-myo-inositol L-arabinosideKEGG COMPOUND
UniProt Name  Source
(indol-3-yl)acetyl-myo-inositol 3-L-arabinosideUniProt
Manual XrefsDatabases
C04611KEGG COMPOUND