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143873-68-1 | β-D-Altrofuranose, 3-amino-3,6-dideoxy-5-C-phenyl-
CAS No: 143873-68-1 Catalog No: AG001IIX MDL No:
Product Description
Catalog Number:
AG001IIX
Chemical Name:
β-D-Altrofuranose, 3-amino-3,6-dideoxy-5-C-phenyl-
CAS Number:
143873-68-1
Molecular Formula:
C12H17NO4
Molecular Weight:
239.2677
IUPAC Name:
(3S,4S,5R)-4-amino-5-[(1R)-1,2-dihydroxy-1-phenylethyl]oxolane-2,3,4-triol
InChI:
InChI=1S/C12H17NO6/c13-12(18)8(15)9(16)19-10(12)11(17,6-14)7-4-2-1-3-5-7/h1-5,8-10,14-18H,6,13H2/t8-,9?,10-,11+,12+/m1/s1
InChI Key:
ALQDYXWZAAOKSL-MGMMNNENSA-N
SMILES:
O[C@@H]1[C@H](O)O[C@@H]([C@H]1N)[C@](c1ccccc1)(O)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
271.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
271.269g/mol
Monoisotopic Mass:
271.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
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