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CHEBI:142256 - Cappariloside A

ChEBI IDCHEBI:142256
ChEBI NameCappariloside A
Stars
Last Modified19 September 2018
Submittermwilliams
DownloadsMolfile
FormulaC16H18N2O6
Net Charge0
Average Mass334.328
Monoisotopic Mass334.11649
SMILESN#CCc1cnc2cccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12
InChIInChI=1S/C16H18N2O6/c17-5-4-8-6-18-9-2-1-3-10(12(8)9)23-16-15(22)14(21)13(20)11(7-19)24-16/h1-3,6,11,13-16,18-22H,4,7H2/t11-,13-,14+,15-,16-/m1/s1
InChIKeyZVFUTZQNUQUJLW-YMILTQATSA-N
ChEBI Ontology
Outgoing Relation(s)
Cappariloside A (CHEBI:142256) has functional parent indole-3-acetonitrile (CHEBI:17566)
Cappariloside A (CHEBI:142256) is a indoles (CHEBI:24828)
Manual XrefsDatabases
9407948ChemSpider
HMDB0034937HMDB