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102029-88-9 | D-Glucopyranose, 2-(acetylamino)-2-deoxy-, 6-(dihydrogen phosphate), disodium salt (9CI)
CAS No: 102029-88-9 Catalog No: AG0006EP MDL No:
Product Description
Catalog Number:
AG0006EP
Chemical Name:
D-Glucopyranose, 2-(acetylamino)-2-deoxy-, 6-(dihydrogen phosphate), disodium salt (9CI)
CAS Number:
102029-88-9
Molecular Formula:
C8H16NNaO9P
Molecular Weight:
324.1775
IUPAC Name:
(5-acetamido-3,4,6-trihydroxyoxan-2-yl)methyl dihydrogen phosphate;sodium
InChI:
InChI=1S/C8H16NO9P.Na/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16;/h4-8,11-13H,2H2,1H3,(H,9,10)(H2,14,15,16);
InChI Key:
VGBNZVULWAHGJF-UHFFFAOYSA-N
SMILES:
CC(=O)NC1C(O)OC(C(C1O)O)COP(=O)(O)O.[Na]
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.046g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
324.178g/mol
Monoisotopic Mass:
324.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
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