Description
IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(1H-indol-3-yloxy)oxane-3,4,5-triol
InChI: InChI=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
InChIKey: XVARCVCWNFACQC-RKQHYHRCSA-N
Canonical SMILES: C1=CC=C2C(=C1)C(=CN2)OC3C(C(C(C(O3)CO)O)O)O
Isomeric SMILES: C1=CC=C2C(=C1)C(=CN2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Synonyms: INDICAN; 487-60-5; 3-Indolyl-b-D-glucopyranoside; 3-Indoxyl-beta-D-glucopyranoside; Indoxyl beta-D-glucoside; 1H-indol-3-yl beta-D-glucopyranoside; Indikan; Indican (plant indican); …
Botanical Source: