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100759-95-3

100759-95-3 | β-D-Glucopyranose, 2-deoxy-2-[(3-hydroxy-1-oxotetradecyl)amino]-, 1,3,4-triacetate 6-(dihydrogen phosphate)

CAS No: 100759-95-3 Catalog No: AG0002TO MDL No:

Product Description

Catalog Number:
AG0002TO
Chemical Name:
β-D-Glucopyranose, 2-deoxy-2-[(3-hydroxy-1-oxotetradecyl)amino]-, 1,3,4-triacetate 6-(dihydrogen phosphate)
CAS Number:
100759-95-3
IUPAC Name:
hydroxy-oxo-[(2R,3S,4R,5R)-2,3,4-trihydroxy-5-(3-hydroxytetradecanoylamino)-6-oxohexoxy]phosphanium
InChI:
InChI=1S/C20H37NO9P/c1-2-3-4-5-6-7-8-9-10-11-15(23)12-18(25)21-16(13-22)19(26)20(27)17(24)14-30-31(28)29/h13,15-17,19-20,23-24,26-27H,2-12,14H2,1H3/q-1/p+2/t15?,16-,17+,19+,20+/m0/s1
InChI Key:
OQVVSIIQXAXOMF-LEJFCBNZSA-P

Properties

Complexity:
509  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
468.236g/mol
Formal Charge:
1  
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
468.504g/mol
Monoisotopic Mass:
468.236g/mol
Rotatable Bond Count:
20  
Topological Polar Surface Area:
174A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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