CHEBI:17391 - 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside
ChEBI ID CHEBI:17391
ChEBI ASCII Name 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:2105, CHEBI:20534, CHEBI:12095
Supplier Information
Download Molfile XML SDF
Formula C22H29NO12
Net Charge 0
Average Mass 499.46520
Monoisotopic Mass 499.16898
InChI InChI=1S/C22H29NO12/c24-7-11-13(26)14(27)18(31)22(33-11)35-21-17(30)15(28)16(29)20(19(21)32)34-12(25)5-8-6-23-10-4-2-1-3-9(8)10/h1-4,6,11,13-24,26-32H,5,7H2/t11-,13+,14+,15-,16+,17+,18-,19-,20+,21-,22?/m1/s1
InChIKey VHFRZSJSHFOBOM-AJQUYQQFSA-N
SMILES OC[C@H]1OC(O[C@@H]2[C@@H](O)[C@H](O)[C@H](O)[C@H](OC(=O)Cc3c[nH]c4ccccc34)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing 5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside (CHEBI:17391) is a D-galactoside (CHEBI:20961)
5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside (CHEBI:17391) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
(1S,2S,3R,4S,5S,6S)-3-(D-galactopyranosyloxy)-2,4,5,6-tetrahydroxycyclohexyl 1H-indol-3-ylacetate
Synonyms Sources
5-O-(indol-3-ylacetyl)-myo-inositol D-galactoside UniProt
5-O-(Indol-3-ylacetyl-myo-inositol) D-galactoside KEGG COMPOUND
Manual Xref Database
C04695 KEGG COMPOUND
View more database links
Last Modified
13 November 2017