disodium [(2S,4R)-3-methylidene-2,4-bis(oxidanyl)-5-oxidanylidene-pentyl] phosphate

Systemtic Name: disodium [(2S,4R)-3-methylidene-2,4-bis(oxidanyl)-5-oxidanylidene-pentyl] phosphate Openeye Name: disodium [(2S,4R)-2,4-dihydroxy-3-methylene-5-oxo-pentyl] phosphate CAS Name: disodium [(2S,4R)-2,4-dihydroxy-3-methylene-5-oxopentyl] phosphate IUPAC Name: disodium [(2S,4R)-2,4-dihydroxy-3-methylidene-5-oxopentyl] phosphate Traditional Name: disodium [(2S)-2-hydroxy-3-[(1R)-1-hydroxy-2-keto-ethyl]but-3-enyl] phosphate Formula: C6H9Na2O7P MolecularWeight: 270.084761

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(COP(=O)([O-])[O-])O)C(C=O)O.[Na+].[Na+]

Isomeric SMILES

C=C([C@@H](COP(=O)([O-])[O-])O)[C@H](C=O)O.[Na+].[Na+]

InChI

InChI=1S/C6H11O7P.2Na/c1-4(5(8)2-7)6(9)3-13-14(10,11)12;;/h2,5-6,8-9H,1,3H2,(H2,10,11,12);;/q;2*+1/p-2/t5-,6+;;/m0../s1