Regaloside A

CAS Registry Number®

114420-66-5

CAS Name

Regaloside A

Molecular Formula

C18H24O10

Molecular Mass

400.38

Cite this Page

Regaloside A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=114420-66-5 (retrieved 2025-02-26) (CAS RN: 114420-66-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24O10/c19-7-13-15(23)16(24)17(25)18(28-13)27-9-12(21)8-26-14(22)6-3-10-1-4-11(20)5-2-10/h1-6,12-13,15-21,23-25H,7-9H2/b6-3+/t12-,13-,15-,16+,17-,18-/m1/s1

InChIKey

InChIKey=PADHSFRQMFRWLS-BFQBLSCMSA-N

SMILES

O(C[C@@H](COC(/C=C/C1=CC=C(O)C=C1)=O)O)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(OCC(O)COC1OC(CO)C(O)C(O)C1O)C=CC2=CC=C(O)C=C2

Other Names for this Substance

  • β-D-Glucopyranoside, (2S)-2-hydroxy-3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]propyl
  • β-D-Glucopyranoside, 2-hydroxy-3-[[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]propyl, [S-(E)]-
  • β-D-Glucopyranoside, (2S)-2-hydroxy-3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]propyl
  • (2S)-2-Hydroxy-3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]propyl β-D-glucopyranoside
  • Regaloside A