β-D-Glucopyranosiduronic acid, 4-formyl-2-methoxyphenyl, methyl ester, 2,3,4-triacetate

CAS Registry Number®

704885-44-9

CAS Name

β-D-Glucopyranosiduronic acid, 4-formyl-2-methoxyphenyl, methyl ester, 2,3,4-triacetate

Molecular Formula

C21H24O12

Molecular Mass

468.41

Cite this Page

β-D-Glucopyranosiduronic acid, 4-formyl-2-methoxyphenyl, methyl ester, 2,3,4-triacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=704885-44-9 (retrieved 2024-12-02) (CAS RN: 704885-44-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    100-102 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H24O12/c1-10(23)29-16-17(30-11(2)24)19(31-12(3)25)21(33-18(16)20(26)28-5)32-14-7-6-13(9-22)8-15(14)27-4/h6-9,16-19,21H,1-5H3/t16-,17-,18-,19+,21+/m0/s1

InChIKey

InChIKey=QTHPZBHVIGLWPP-VDRZXAFZSA-N

SMILES

O(C(C)=O)[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](C(OC)=O)O[C@H]1OC2=C(OC)C=C(C=O)C=C2

Canonical SMILES

O=CC1=CC=C(OC2OC(C(=O)OC)C(OC(=O)C)C(OC(=O)C)C2OC(=O)C)C(OC)=C1

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, 4-formyl-2-methoxyphenyl, methyl ester, 2,3,4-triacetate
  • β-D-Glucopyranosiduronic acid, 4-formyl-2-methoxyphenyl, methyl ester, triacetate

CAS INSIGHTSTM
Hourglass and a clock