Methyl (2E)-3-[4-(β-D-glucopyranosyloxy)phenyl]-2-propenoate

CAS Registry Number®

554-87-0

CAS Name

Methyl (2E)-3-[4-(β-D-glucopyranosyloxy)phenyl]-2-propenoate

Molecular Formula

C16H20O8

Molecular Mass

340.33

Cite this Page

Methyl (2E)-3-[4-(β-D-glucopyranosyloxy)phenyl]-2-propenoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=554-87-0 (retrieved 2024-11-26) (CAS RN: 554-87-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    162-164 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H20O8/c1-22-12(18)7-4-9-2-5-10(6-3-9)23-16-15(21)14(20)13(19)11(8-17)24-16/h2-7,11,13-17,19-21H,8H2,1H3/b7-4+/t11-,13-,14+,15-,16-/m1/s1

InChIKey

InChIKey=KPYQJVYNSWDFQU-ORXIWHNOSA-N

SMILES

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

Canonical SMILES

O=C(OC)C=CC1=CC=C(OC2OC(CO)C(O)C(O)C2O)C=C1

Other Names for this Substance

  • 2-Propenoic acid, 3-[4-(β-D-glucopyranosyloxy)phenyl]-, methyl ester, (2E)-
  • Linocinnamarin
  • 2-Propenoic acid, 3-[4-(β-D-glucopyranosyloxy)phenyl]-, methyl ester, (E)-
  • Methyl (2E)-3-[4-(β-D-glucopyranosyloxy)phenyl]-2-propenoate

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