Trigalacturonic acid

CAS Registry Number®

6037-45-2
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CAS Name

Trigalacturonic acid

Molecular Formula

C18H26O19

Molecular Mass

546.39

Cite this Page

Trigalacturonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6037-45-2 (retrieved 2024-04-27) (CAS RN: 6037-45-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H26O19/c19-1-2(20)3(21)10(9(27)14(28)29)34-18-8(26)6(24)11(13(37-18)16(32)33)35-17-7(25)4(22)5(23)12(36-17)15(30)31/h1-13,17-18,20-27H,(H,28,29)(H,30,31)(H,32,33)/t2-,3+,4-,5+,6+,7+,8+,9-,10+,11+,12-,13-,17-,18-/m0/s1

InChIKey

InChIKey=FMNDXLWVYMQMHF-XKLWFNJZSA-N

SMILES

O([C@H]1[C@@H](C(O)=O)O[C@H](O[C@H]([C@@H]([C@H](C=O)O)O)[C@@H](C(O)=O)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=CC(O)C(O)C(OC1OC(C(=O)O)C(OC2OC(C(=O)O)C(O)C(O)C2O)C(O)C1O)C(O)C(=O)O

Other Names for this Substance

  • D-Galacturonic acid, O-α-D-galactopyranuronosyl-(1→4)-O-α-D-galactopyranuronosyl-(1→4)-
  • Trigalacturonic acid
  • Galacturonic acid, O-α-D-galactopyranuronosyl-(1→4)-O-α-D-galactopyranuronosyl-(1→4)-
  • O-α-D-Galactopyranuronosyl-(1→4)-O-α-D-galactopyranuronosyl-(1→4)-D-galacturonic acid

Deleted or Replaced CAS Registry Numbers

143120-92-7, 24008-92-2, 34431-61-3, 199339-31-6

CAS INSIGHTSTM
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