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10030-85-0 | L-Mannose, 6-deoxy-, hydrate (1:1)
CAS No: 10030-85-0 Catalog No: AG0001IZ MDL No:MFCD00150842
Product Description
Catalog Number:
AG0001IZ
Chemical Name:
L-Mannose, 6-deoxy-, hydrate (1:1)
CAS Number:
10030-85-0
Molecular Formula:
C6H14O6
Molecular Weight:
182.1718
MDL Number:
MFCD00150842
IUPAC Name:
(2R,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanal;hydrate
InChI:
InChI=1S/C6H12O5.H2O/c1-3(8)5(10)6(11)4(9)2-7;/h2-6,8-11H,1H3;1H2/t3-,4-,5-,6-;/m0./s1
InChI Key:
CBDCDOTZPYZPRO-DEZHIRTDSA-N
SMILES:
O=C[C@@H]([C@@H]([C@H]([C@@H](O)C)O)O)O.O
EC Number:
600-058-2
UNII:
8FBR580ITD
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
182.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
182.172g/mol
Monoisotopic Mass:
182.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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