β-D-Glucopyranose, 6-[(2E)-3-phenyl-2-propenoate] 1-(3,4,5-trihydroxybenzoate)

CAS Registry Number®

115746-69-5
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CAS Name

β-D-Glucopyranose, 6-[(2E)-3-phenyl-2-propenoate] 1-(3,4,5-trihydroxybenzoate)

Molecular Formula

C22H22O11

Molecular Mass

462.40

Cite this Page

β-D-Glucopyranose, 6-[(2E)-3-phenyl-2-propenoate] 1-(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=115746-69-5 (retrieved 2024-09-08) (CAS RN: 115746-69-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H22O11/c23-13-8-12(9-14(24)17(13)26)21(30)33-22-20(29)19(28)18(27)15(32-22)10-31-16(25)7-6-11-4-2-1-3-5-11/h1-9,15,18-20,22-24,26-29H,10H2/b7-6+/t15-,18-,19+,20-,22+/m1/s1

InChIKey

InChIKey=REBRERQNUHGTMS-PCGJYRBUSA-N

SMILES

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

Canonical SMILES

O=C(OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O)C=CC=3C=CC=CC3

Other Names for this Substance

  • β-D-Glucopyranose, 6-[(2E)-3-phenyl-2-propenoate] 1-(3,4,5-trihydroxybenzoate)
  • β-D-Glucopyranose, 6-(3-phenyl-2-propenoate) 1-(3,4,5-trihydroxybenzoate), (E)-
  • β-D-Glucopyranose 6-[(2E)-3-phenyl-2-propenoate] 1-(3,4,5-trihydroxybenzoate)