Home Other Building Blocks 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL NITROMETHANE

2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL NITROMETHANE

CAS No.:
129601-61-2
Catalog Number:
AG009C0G
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009C0G
Chemical Name:
2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL NITROMETHANE
CAS Number:
129601-61-2
MDL Number:
MFCD08703981
IUPAC Name:
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(nitromethyl)oxan-3-yl]acetamide
InChI:
InChI=1S/C9H16N2O7/c1-4(13)10-7-5(2-11(16)17)18-6(3-12)8(14)9(7)15/h5-9,12,14-15H,2-3H2,1H3,(H,10,13)/t5-,6+,7-,8+,9+/m0/s1
InChI Key:
PCMVQIJQFUEEIB-KVEIKIFDSA-N
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
264.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
264.234g/mol
Monoisotopic Mass:
264.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2  
Properties