4-O-α-D-Galactopyranuronosyl-α-D-galactopyranuronic acid

CAS Registry Number®

28144-27-6

CAS Name

4-O-α-D-Galactopyranuronosyl-α-D-galactopyranuronic acid

Molecular Formula

C12H18O13

Molecular Mass

370.26

Cite this Page

4-O-α-D-Galactopyranuronosyl-α-D-galactopyranuronic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28144-27-6 (retrieved 2024-12-29) (CAS RN: 28144-27-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    120-122 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18O13/c13-1-2(14)7(9(18)19)25-12(5(1)17)24-6-3(15)4(16)11(22)23-8(6)10(20)21/h1-8,11-17,22H,(H,18,19)(H,20,21)/t1-,2+,3+,4+,5+,6+,7-,8-,11-,12-/m0/s1

InChIKey

InChIKey=IGSYEZFZPOZFNC-MMGXBETBSA-N

SMILES

O([C@H]1[C@@H](C(O)=O)O[C@H](O)[C@H](O)[C@H]1O)[C@H]2O[C@H](C(O)=O)[C@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(O)C1OC(OC2C(O)C(O)C(O)OC2C(=O)O)C(O)C(O)C1O

Other Names for this Substance

  • α-D-Galactopyranuronic acid, 4-O-α-D-galactopyranuronosyl-
  • Galactopyranuronic acid, 4-O-α-D-galactopyranuronosyl-, α-D-
  • 4-O-α-D-Galactopyranuronosyl-α-D-galactopyranuronic acid
  • Digalacturonic acid

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