(2S)-5-(β-D-Glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indole-2-carboxylic acid

CAS Registry Number®

71242-23-4
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CAS Name

(2S)-5-(β-D-Glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indole-2-carboxylic acid

Molecular Formula

C15H19NO9

Molecular Mass

357.31

Cite this Page

(2S)-5-(β-D-Glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indole-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71242-23-4 (retrieved 2024-09-19) (CAS RN: 71242-23-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H19NO9/c17-4-10-11(19)12(20)13(21)15(25-10)24-9-2-5-1-7(14(22)23)16-6(5)3-8(9)18/h2-3,7,10-13,15-21H,1,4H2,(H,22,23)/t7-,10+,11+,12-,13+,15+/m0/s1

InChIKey

InChIKey=PXMFPPFHRQZIHO-OLCQZNMOSA-N

SMILES

O(C=1C=C2C(N[C@H](C(O)=O)C2)=CC1O)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O

Canonical SMILES

O=C(O)C1NC2=CC(O)=C(OC3OC(CO)C(O)C(O)C3O)C=C2C1

Other Names for this Substance

  • 1H-Indole-2-carboxylic acid, 5-(β-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-, (2S)-
  • 1H-Indole-2-carboxylic acid, 5-(β-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-, (S)-
  • (2S)-5-(β-D-Glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indole-2-carboxylic acid