Fosfructose trisodium

trisodium;hydron;[(2R,3S,4S)-3,4,5-trihydroxy-5-(phosphonatooxymethyl)oxolan-2-yl]methyl phosphate;octahydrate

Also Known As: Fosfructose trisodium|Harden-Young-Ester|fdp-na3h octahydrate|fdp 2~8 br|trisodium fructose diphosphate|Fosfructose trisodium (USAN)|Fosfructose trisodium [USAN]|Fosfructose trisodium octahydrate|fructose-1,6-biphosphate-na3-salt|C6H11Na3O12P2 x 8H2O|d-fructose-1,6-biphosphate na3-salt|d-fructose 1,6-bisphosphate trisodium sa|C6-H11-Na3-O12-P2 x 8H2-O|D-Fructose-1,6-diphosphate trisodium salt octahydrate|I14-99002|(1R,2S)-(-)-alpha-(1-Methylaminoethyl)benzyl alcohol nitrate|D-Fructose, 1,6-bis(dihydrogen phosphate), trisodium salt, octahydrate|trisodium; hydron; [(2R,3S,4S)-3,4,5-trihydroxy-5-(phosphonatooxymethyl)oxolan-2-yl]methyl phosphate; octahydrate|trisodium; hydron; [(2R,3S,4S)-3,4,5-trihydroxy-5-(phosphonatooxymethyl)tetrahydrofuran-2-yl]methyl phosphate; octahydrate

Molecular Formula	C6H27Na3O20P2
Molecular Weight	550.0264 g/mol
LogP	-20.9869
Topological Polar Surface Area	223.0 Ų
Hydrogen Bond Donors	12
Hydrogen Bond Acceptors	20
Rotatable Bonds	4
Exact Mass	550.0264
Monoisotopic Mass	550.0264
Heavy Atoms	31
Complexity	405.0

Chemical Identifiers

CAS Number	81028-91-3
SMILES	[H+].C([C@@H]1[C@H]([C@@H](C(O1)(COP(=O)([O-])[O-])O)O)O)OP(=O)([O-])[O-].O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+]
InChIKey	DBTJWGHAMYSWQR-OLMHPWOBSA-K