2-(hydroxymethyl)pentane-1,5-diol thiophosphate

Systemtic Name: 2-(hydroxymethyl)pentane-1,5-diol thiophosphate Openeye Name: 2-(hydroxymethyl)pentane-1,5-diol thiophosphate CAS Name: 2-(hydroxymethyl)pentane-1,5-diol thiophosphate IUPAC Name: 2-(hydroxymethyl)pentane-1,5-diol thiophosphate Traditional Name: 2-methylolpentane-1,5-diol thiophosphate Formula: C6H14O6PS-3 MolecularWeight: 245.210521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H14O3.H3O3PS/c7-3-1-2-6(4-8)5-9;1-4(2,3)5/h6-9H,1-5H2;(H3,1,2,3,5)/p-3