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263155-12-0 | D-glycero-D-galacto-Non-2-enonic acid, 4-amino-2,6-anhydro-3,4-dideoxy-
CAS No: 263155-12-0 Catalog No: AG002SOF MDL No:
Product Description
Catalog Number:
AG002SOF
Chemical Name:
D-glycero-D-galacto-Non-2-enonic acid, 4-amino-2,6-anhydro-3,4-dideoxy-
CAS Number:
263155-12-0
Molecular Formula:
C9H15NO7
Molecular Weight:
249.2179
IUPAC Name:
4-amino-3-hydroxy-2-[(1R,2R)-1,2,3-trihydroxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
InChI:
InChI=1S/C9H15NO7/c10-3-1-5(9(15)16)17-8(6(3)13)7(14)4(12)2-11/h1,3-4,6-8,11-14H,2,10H2,(H,15,16)/t3?,4-,6?,7-,8?/m1/s1
InChI Key:
DLPBPEUAQGGZEN-SDDMMPNHSA-N
SMILES:
OC[C@H]([C@H]([C@@H]1OC(=C[C@@H]([C@H]1O)N)C(=O)O)O)O
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
249.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
249.219g/mol
Monoisotopic Mass:
249.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
154A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-5
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