β-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl, 6-(3,4-dihydroxybenzeneacetate)

CAS Registry Number®

914649-26-6
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CAS Name

β-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl, 6-(3,4-dihydroxybenzeneacetate)

Molecular Formula

C22H26O11

Molecular Mass

466.44

Cite this Page

β-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl, 6-(3,4-dihydroxybenzeneacetate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=914649-26-6 (retrieved 2024-09-19) (CAS RN: 914649-26-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H26O11/c23-13-3-1-11(7-15(13)25)5-6-31-22-21(30)20(29)19(28)17(33-22)10-32-18(27)9-12-2-4-14(24)16(26)8-12/h1-4,7-8,17,19-26,28-30H,5-6,9-10H2/t17-,19-,20+,21-,22-/m1/s1

InChIKey

InChIKey=UYICXCOMJPCYON-MIUGBVLSSA-N

SMILES

O(CCC1=CC(O)=C(O)C=C1)[C@@H]2O[C@H](COC(CC3=CC(O)=C(O)C=C3)=O)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(OCC1OC(OCCC2=CC=C(O)C(O)=C2)C(O)C(O)C1O)CC3=CC=C(O)C(O)=C3

Other Names for this Substance

  • β-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl, 6-(3,4-dihydroxybenzeneacetate)
  • Ternstroside D