Methyl 2-[(5-Nitro-1,3-Thiazol-2-Yl)Carbamoyl]Phenyl (5xi)-2,3,4-Tri-O-Acetyl-beta-L-Lyxo-Hexopyranosiduronate
[CAS# 221287-92-9]

Identification

• Name: Methyl 2-[(5-Nitro-1,3-Thiazol-2-Yl)Carbamoyl]Phenyl (5xi)-2,3,4-Tri-O-Acetyl-beta-L-Lyxo-Hexopyranosiduronate
• Synonyms: Methyl 1-[[2-N-(5-Nitrothiazolyl)carboxamido]phenyl]-2,3,4- tri-O-acetyl-¦Â-D-glucopyranuronate
• Molecular Formula: C₂₃H₂₃N₃O₁₃S
• Molecular Weight: 581.51
• CAS Registry Number: 221287-92-9
• SMILES: CC(=O)O[C@H]1[C@H]([C@H](OC([C@@H]1OC(=O)C)C(=O)OC)Oc2ccccc2C(=O)Nc3ncc(s3)[N+](=O)[O-])OC(=O)C
• InChI: 1S/C23H23N3O13S/c1-10(27)35-16-17(36-11(2)28)19(37-12(3)29)22(39-18(16)21(31)34-4)38-14-8-6-5-7-13(14)20(30)25-23-24-9-15(40-23)26(32)33/h5-9,16-19,22H,1-4H3,(H,24,25,30)/t16-,17-,18?,19-,22+/m1/s1
• InChIKey: JZMCAGQTKJRRDM-SHESHIBESA-N

Properties

• Density: 1.515g/cm³ (Cal.)
• Refractive index: 1.597 (Cal.)