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CHEBI:16700 - indican

ChEBI IDCHEBI:16700
ChEBI Nameindican
Stars
Secondary ChEBI IDsCHEBI:5895, CHEBI:14438
Last Modified20 April 2017
DownloadsMolfile
FormulaC14H17NO6
Net Charge0
Average Mass295.291
Monoisotopic Mass295.10559
SMILESOC[C@H]1O[C@@H](Oc2cnc3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C14H17NO6/c16-6-10-11(17)12(18)13(19)14(21-10)20-9-5-15-8-4-2-1-3-7(8)9/h1-5,10-19H,6H2/t10-,11-,12+,13-,14-/m1/s1
InChIKeyXVARCVCWNFACQC-RKQHYHRCSA-N
ChEBI Ontology
Outgoing Relation(s)
indican (CHEBI:16700) is a exopolysaccharide (CHEBI:72813)
indican (CHEBI:16700) is a indolyl carbohydrate (CHEBI:24821)
indican (CHEBI:16700) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
1H-indol-3-yl β-D-glucopyranoside
Synonyms  Source
IndicanKEGG COMPOUND
Indican, plantKEGG COMPOUND
UniProt Name  Source
indicanUniProt
Manual XrefsDatabases
C00001541KNApSAcK
C08481KEGG COMPOUND
Registry NumbersSources
CAS:487-60-5KEGG COMPOUND