57865-92-6
METHYL 3-ACETAMIDO-4-O-BENZOYL-6-BROMO-2,3,6-TRIDEOXY-ALPHA-D-RIBO-HEXOPYRANOSIDE
Name
METHYL 3-ACETAMIDO-4-O-BENZOYL-6-BROMO-2,3,6-TRIDEOXY-ALPHA-D-RIBO-HEXOPYRANOSIDE
Formula
C16 H20 Br N O5
MolWeight
386.24
1Identification
【Name】
METHYL 3-ACETAMIDO-4-O-BENZOYL-6-BROMO-2,3,6-TRIDEOXY-ALPHA-D-RIBO-HEXOPYRANOSIDE
【CAS】
【MDL】
MFCD15145061
【English Synonyms】
【Formula】
C16 H20 Br N O5
【MolWeight】
386.24
【Inchi】
InChI=1S/C16H20BrNO5/c1-10(19)18-12-8-14(21-2)22-13(9-17)15(12)23-16(20)11-6-4-3-5-7-11/h3-7,12-15H,8-9H2,1-2H3,(H,18,19)/t12-,13+,14-,15-/m0/s1
【InChIKey】
InChIKey=JZLAUALBZXMLIS-XGUBFFRZSA-N
【SMILES】
CC(=O)N[C@H]1C[C@H](O[C@@H]([C@H]1OC(=O)c2ccccc2)CBr)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4CML File
METHYL 3-ACETAMIDO-4-O-BENZOYL-6-BROMO-2,3,6-TRIDEOXY-ALPHA-D-RIBO-HEXOPYRANOSIDE.cml
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