β-D-Glucopyranoside, 4-hydroxyphenyl, 2-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]

CAS Registry Number®

230955-36-9

CAS Name

β-D-Glucopyranoside, 4-hydroxyphenyl, 2-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]

Molecular Formula

C21H22O10

Molecular Mass

434.39

Cite this Page

β-D-Glucopyranoside, 4-hydroxyphenyl, 2-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=230955-36-9 (retrieved 2025-01-31) (CAS RN: 230955-36-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H22O10/c22-10-16-18(27)19(28)20(21(30-16)29-13-5-3-12(23)4-6-13)31-17(26)8-2-11-1-7-14(24)15(25)9-11/h1-9,16,18-25,27-28H,10H2/b8-2+/t16-,18-,19+,20-,21-/m1/s1

InChIKey

InChIKey=SAHZOJQMDIDFST-CTPWMPFQSA-N

SMILES

O([C@H]1[C@H](OC(/C=C/C2=CC(O)=C(O)C=C2)=O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C3=CC=C(O)C=C3

Canonical SMILES

O=C(OC1C(OC2=CC=C(O)C=C2)OC(CO)C(O)C1O)C=CC3=CC=C(O)C(O)=C3

Other Names for this Substance

  • β-D-Glucopyranoside, 4-hydroxyphenyl, 2-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate]