Home Other Building Blocks D-Fructose, 4-O-α-D-glucopyranosyl-, monohydrate (9CI)

D-Fructose, 4-O-α-D-glucopyranosyl-, monohydrate (9CI)

CAS No.:
207511-09-9
Catalog Number:
AG002J32
Molecular Formula:
C12H24O12
Molecular Weight:
360.3118
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Product Description
Catalog Number:
AG002J32
Chemical Name:
D-Fructose, 4-O-α-D-glucopyranosyl-, monohydrate (9CI)
CAS Number:
207511-09-9
Molecular Formula:
C12H24O12
Molecular Weight:
360.3118
MDL Number:
MFCD00217057
IUPAC Name:
(3S,4R,5R)-1,3,5,6-tetrahydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-one;hydrate
InChI:
InChI=1S/C12H22O11.H2O/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12;/h5-15,17-21H,1-3H2;1H2/t5-,6-,7-,8-,9+,10-,11-,12-;/m1./s1
InChI Key:
IHNLNTFVNSVIFH-OEFDZIMQSA-N
SMILES:
OC[C@H]([C@H]([C@@H](C(=O)CO)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)O.O
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
8  
Defined Bond Stereocenter Count:
0
Exact Mass:
360.127g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
9  
Isotope Atom Count:
0
Molecular Weight:
360.312g/mol
Monoisotopic Mass:
360.127g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
198A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties