2,4,7,8,9-Penta-O-acetyl N-acetylneuraminic acid (4S,5R,6R)-5-乙酰氨基-2,4-二乙酰氧基-6-((1S,2R)-1,2,3-三乙酰氧基丙基)四氢-2H-吡喃-2-甲酸

CAS 4887-11-0 MFCD14702332

化学结构图

4887-11-0
SMILES: CC(=O)N[C@@H]1[C@@H](OC(C)=O)C[C@@](OC(C)=O)(C(=O)O)O[C@H]1[C@H](OC(C)=O)[C@@H](COC(C)=O)OC(C)=O

化学属性

Mol. FormulaC21H29NO14
Mol. Weight519.45

别名和识别编码

Chemical Name Translation (4S,5R,6R)-5-乙酰氨基-2,4-二乙酰氧基-6-((1S,2R)-1,2,3-三乙酰氧基丙基)四氢-2H-吡喃-2-甲酸
PubChem Substance ID11124156
InChIInChI=1S/C21H29NO14/c1-9(23)22-17-15(32-11(3)25)7-21(20(29)30,35-14(6)28)36-19(17)18(34-13(5)27)16(33-12(4)26)8-31-10(2)24/h15-19H,7-8H2,1-6H3,(H,22,23)(H,29,30)/t15-,16+,17+,18+,19+,21-/m0/s1
CAS Number4887-11-0
Synonym (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {} {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {} {} {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {} {} {} {} {LY} (4S,5R,6R)-5-acetamido-2,4-diacetoxy-6-((1S,2R)-1,2,3-triacetoxypropyl)tetrahydro-2H-pyran-2-carboxylic acid {} {} {} {} {}
Canonical SMILESCC(OC[C@@H](OC(C)=O)[C@H]([C@@]1([H])[C@@H]([C@H](CC(C(O)=O)(O1)OC(C)=O)OC(C)=O)NC(C)=O)OC(C)=O)=O
MDL NumberMFCD18643103
Chemical Name2,4,7,8,9-Penta-O-acetyl N-acetylneuraminic acid
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