4-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]phenyl β-D-glucopyranoside 6-(3,4,5-trihydroxybenzoate)

CAS Registry Number®

64898-03-9

CAS Name

4-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]phenyl β-D-glucopyranoside 6-(3,4,5-trihydroxybenzoate)

Molecular Formula

C27H26O12

Molecular Mass

542.49

Cite this Page

4-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]phenyl β-D-glucopyranoside 6-(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64898-03-9 (retrieved 2024-11-24) (CAS RN: 64898-03-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H26O12/c28-16-7-14(8-17(29)11-16)2-1-13-3-5-18(6-4-13)38-27-25(35)24(34)23(33)21(39-27)12-37-26(36)15-9-19(30)22(32)20(31)10-15/h1-11,21,23-25,27-35H,12H2/b2-1+/t21-,23-,24+,25-,27-/m1/s1

InChIKey

InChIKey=HQQSMUBDNVIUPF-XMPPFBFMSA-N

SMILES

O([C@@H]1O[C@H](COC(=O)C2=CC(O)=C(O)C(O)=C2)[C@@H](O)[C@H](O)[C@H]1O)C3=CC=C(/C=C/C4=CC(O)=CC(O)=C4)C=C3

Canonical SMILES

O=C(OCC1OC(OC2=CC=C(C=C2)C=CC=3C=C(O)C=C(O)C3)C(O)C(O)C1O)C4=CC(O)=C(O)C(O)=C4

Other Names for this Substance

  • β-D-Glucopyranoside, 4-[(1E)-2-(3,5-dihydroxyphenyl)ethenyl]phenyl, 6-(3,4,5-trihydroxybenzoate)
  • β-D-Glucopyranoside, 4-[2-(3,5-dihydroxyphenyl)ethenyl]phenyl, 6-(3,4,5-trihydroxybenzoate), (E)-
  • 4-[(1E)-2-(3,5-Dihydroxyphenyl)ethenyl]phenyl β-D-glucopyranoside 6-(3,4,5-trihydroxybenzoate)

CAS INSIGHTSTM
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