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Home > Nitro Compounds > 73427-33-5
73427-33-5 | S-nitroso-beta-D-thioglucose
CAS No: 73427-33-5 Catalog No: AG00FW7O MDL No:
Product Description
Catalog Number:
AG00FW7O
Chemical Name:
S-nitroso-beta-D-thioglucose
CAS Number:
73427-33-5
IUPAC Name:
(2R,5R,6S)-6-aminooxy-2-(hydroxymethyl)-6-sulfanyl-2,5-dihydropyran-3,4,5-triol
InChI:
InChI=1S/C6H11NO6S/c7-13-6(14)5(11)4(10)3(9)2(1-8)12-6/h2,5,8-11,14H,1,7H2/t2-,5-,6+/m1/s1
InChI Key:
KNSMFAYATDJFEI-LNFGEOLWSA-N
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
225.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
225.215g/mol
Monoisotopic Mass:
225.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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