β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]
CAS Registry Number®
102623-18-7
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CAS Name
β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]Molecular Formula
C21H23NO8Molecular Mass
417.41Cite this Page
β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=102623-18-7 (retrieved ) (CAS RN: 102623-18-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H23NO8/c1-10-6-5-9-13(11(10)2)22-14-8-4-3-7-12(14)20(28)30-21-17(25)15(23)16(24)18(29-21)19(26)27/h3-9,15-18,21-25H,1-2H3,(H,26,27)/t15-,16-,17+,18-,21-/m0/s1
InChIKey
InChIKey=DAHIGOGKMFBIOR-CURYNPBISA-N
SMILES
N(C1=C(C(O[C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O)=O)C=CC=C1)C3=C(C)C(C)=CC=C3
Canonical SMILES
O=C(O)C1OC(OC(=O)C=2C=CC=CC2NC3=CC=CC(=C3C)C)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]
- Mefenamic acid glucuronide
