2-(hydroxymethyl)butane-1,4-diol thiophosphate

Systemtic Name: 2-(hydroxymethyl)butane-1,4-diol thiophosphate Openeye Name: 2-(hydroxymethyl)butane-1,4-diol thiophosphate CAS Name: 2-(hydroxymethyl)butane-1,4-diol thiophosphate IUPAC Name: 2-(hydroxymethyl)butane-1,4-diol thiophosphate Traditional Name: 2-methylolbutane-1,4-diol thiophosphate Formula: C5H12O6PS-3 MolecularWeight: 231.183941

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)C(CO)CO.[O-]P(=S)([O-])[O-]

Isomeric SMILES

C(CO)C(CO)CO.[O-]P(=S)([O-])[O-]

InChI

InChI=1S/C5H12O3.H3O3PS/c6-2-1-5(3-7)4-8;1-4(2,3)5/h5-8H,1-4H2;(H3,1,2,3,5)/p-3