Digalacturonic acid
CAS Registry Number®
5894-59-7
CAS Name
Digalacturonic acidMolecular Formula
C12H18O13Molecular Mass
370.26Cite this Page
Digalacturonic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5894-59-7 (retrieved ) (CAS RN: 5894-59-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H18O13/c13-1-2(14)3(15)8(7(19)10(20)21)24-12-6(18)4(16)5(17)9(25-12)11(22)23/h1-9,12,14-19H,(H,20,21)(H,22,23)/t2-,3+,4-,5+,6+,7-,8+,9-,12-/m0/s1
InChIKey
InChIKey=SYBQLSSECRIKMJ-GYIVVZTQSA-N
SMILES
O([C@H]([C@@H]([C@H](C=O)O)O)[C@@H](C(O)=O)O)[C@H]1O[C@H](C(O)=O)[C@H](O)[C@H](O)[C@H]1O
Canonical SMILES
O=CC(O)C(O)C(OC1OC(C(=O)O)C(O)C(O)C1O)C(O)C(=O)O
Other Names for this Substance
- D-Galacturonic acid, 4-O-α-D-galactopyranuronosyl-
- Galacturonic acid, 4-O-α-D-galactopyranuronosyl-, D-
- 4-O-α-D-Galactopyranuronosyl-D-galacturonic acid
- Digalacturonic acid
Deleted or Replaced CAS Registry Numbers
30753-76-5, 199339-30-5, 902141-54-2