50729-97-0
4-氯苯基-2-乙酰氨基-3,4,6-三-氧-乙酰基-2-脱氧-Β-D-葡萄糖苷
Name
4-氯苯基-2-乙酰氨基-3,4,6-三-氧-乙酰基-2-脱氧-Β-D-葡萄糖苷
pro_formula
C20 H24 Cl N O9
pro_molWeight
457.861
1Identification
【Name】
4-氯苯基-2-乙酰氨基-3,4,6-三-氧-乙酰基-2-脱氧-Β-D-葡萄糖苷
【CAS】
【MDL】
MFCD08704062
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C20 H24 Cl N O9
【pro_molWeight】
457.861
【Inchi】
InChI=1S/C20H24ClNO9/c1-10(23)22-17-19(29-13(4)26)18(28-12(3)25)16(9-27-11(2)24)31-20(17)30-15-7-5-14(21)6-8-15/h5-8,16-20H,9H2,1-4H3,(H,22,23)/t16-,17-,18-,19-,20-/m1/s1
【InChIKey】
InChIKey=WYEQTOCFACZKOK-LASHMREHSA-N
【SMILES】
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1Oc2ccc(cc2)Cl)COC(=O)C)OC(=O)C)OC(=O)C
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:10
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
4-氯苯基-2-乙酰氨基-3,4,6-三-氧-乙酰基-2-脱氧-Β-D-葡萄糖苷.cml
quick_release
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