140712-80-7
N-苯甲酰基-3'-O-(4,4'-二甲氧基三苯甲基)-2'-脱氧胞啶
Name
N-苯甲酰基-3'-O-(4,4'-二甲氧基三苯甲基)-2'-脱氧胞啶
pro_formula
C37 H35 N3 O7
pro_molWeight
633.698
1Identification
【Name】
N-苯甲酰基-3'-O-(4,4'-二甲氧基三苯甲基)-2'-脱氧胞啶
【CAS】
【MDL】
MFCD04972285
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C37 H35 N3 O7
【pro_molWeight】
633.698
【Inchi】
InChI=1S/C37H35N3O7/c1-44-29-17-13-27(14-18-29)37(26-11-7-4-8-12-26,28-15-19-30(45-2)20-16-28)47-31-23-34(46-32(31)24-41)40-22-21-33(39-36(40)43)38-35(42)25-9-5-3-6-10-25/h3-22,31-32,34,41H,23-24H2,1-2H3,(H,38,39,42,43)/t31-,32+,34+/m0/s1
【InChIKey】
InChIKey=PTIHHTLJYOOJIY-VOTWKOMSSA-N
【SMILES】
COc1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)OC)O[C@H]4C[C@@H](O[C@@H]4CO)n5ccc(nc5=O)NC(=O)c6ccccc6
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:10
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
N-苯甲酰基-3'-O-(4,4'-二甲氧基三苯甲基)-2'-脱氧胞啶.cml
quick_release
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pro_catalogNo:Y-1125-001G 1G
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