4-O-[2-(Acetylamino)-2-deoxy-β-D-glucopyranosyl]-β-D-glucopyranuronic acid

CAS Registry Number®

139626-60-1

CAS Name

4-O-[2-(Acetylamino)-2-deoxy-β-D-glucopyranosyl]-β-D-glucopyranuronic acid

Molecular Formula

C14H23NO12

Molecular Mass

397.33

Cite this Page

4-O-[2-(Acetylamino)-2-deoxy-β-D-glucopyranosyl]-β-D-glucopyranuronic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139626-60-1 (retrieved 2024-11-22) (CAS RN: 139626-60-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H23NO12/c1-3(17)15-5-7(19)6(18)4(2-16)25-14(5)27-10-8(20)9(21)13(24)26-11(10)12(22)23/h4-11,13-14,16,18-21,24H,2H2,1H3,(H,15,17)(H,22,23)/t4-,5-,6-,7-,8-,9-,10+,11+,13-,14+/m1/s1

InChIKey

InChIKey=LJKKEBYAXYCTNF-GIXQJHCPSA-N

SMILES

O([C@H]1[C@H](NC(C)=O)[C@@H](O)[C@H](O)[C@@H](CO)O1)[C@@H]2[C@@H](C(O)=O)O[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(O)C1OC(O)C(O)C(O)C1OC2OC(CO)C(O)C(O)C2NC(=O)C

Other Names for this Substance

  • β-D-Glucopyranuronic acid, 4-O-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl]-
  • 4-O-[2-(Acetylamino)-2-deoxy-β-D-glucopyranosyl]-β-D-glucopyranuronic acid

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