30824-21-6 , 对乙酰氨基苯基-2,3,4-O-三乙酰基-beta-D-葡萄糖醛酸甲酯, CAS:30824-21-6

30824-21-6 , 4-Acetamidophenyl 2,3,4-tri-O-acetyl-b-D-glucuronide methyl ester,
对乙酰氨基苯基-2,3,4-O-三乙酰基-beta-D-葡萄糖醛酸甲酯,
CAS:30824-21-6
C21H25NO11 / 467.42
MFCD03701110

4-Acetamidophenyl-2,3,4-tri-O-acetyl-b-D-glucuronide methyl ester

对乙酰氨基苯基-2,3,4-O-三乙酰基-beta-D-葡萄糖醛酸甲酯,

CAS Number	30824-21-6
Product Name	4-Acetamidophenyl-2,3,4-tri-O-acetyl-b-D-glucuronide methyl ester
IUPAC Name	methyl (2S,3S,4S,5R,6S)-6-(4-acetamidophenoxy)-3,4,5-triacetyloxyoxane-2-carboxylate
Molecular Formula	C21H25NO11
Molecular Weight	467.42 g/mol
InChI	InChI=1S/C21H25NO11/c1-10(23)22-14-6-8-15(9-7-14)32-21-19(31-13(4)26)17(30-12(3)25)16(29-11(2)24)18(33-21)20(27)28-5/h6-9,16-19,21H,1-5H3,(H,22,23)/t16-,17-,18-,19+,21+/m0/s1
InChI Key	CGFRFKWGBUUPFU-VDRZXAFZSA-N
SMILES	CC(=O)NC1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C
Synonyms	4-(Acetylamino)phenyl β-D-Glucopyranosiduronic Acid Methyl Ester 2,3,4-Triacetate; p-Acetamidophenyl β-D-Glucopyranosiduronic Acid Methyl Ester 2,3,4-Triacetate
Canonical SMILES	CC(=O)NC1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C
Isomeric SMILES	CC(=O)NC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

CAS No: 30824-21-6 Synonyms: 4-Acetamidophenyl-triacetyl-b-D-glucuronic acid methyl ester MDL No: MFCD03701110 Chemical Formula: C21H25NO11 Molecular Weight: 467.42

References: 1. Calder I., et al.,, J. Med. Chem., 181, 24, p988

上一个：4148-71-4 , 甲基-2,3:4,6-O-二苄叉-alpha-D-吡喃甘露糖苷, 下一个：38229-74-2 , 对溴苯基-2-乙酰氨基-3,4,6-O-三乙酰基-2-脱氧-be