2-(hydroxymethyl)-2-methyl-propane-1,3-diol trisulfate

Systemtic Name: 2-(hydroxymethyl)-2-methyl-propane-1,3-diol trisulfate Openeye Name: 2-(hydroxymethyl)-2-methyl-propane-1,3-diol trisulfate CAS Name: 2-(hydroxymethyl)-2-methylpropane-1,3-diol trisulfate IUPAC Name: 2-(hydroxymethyl)-2-methylpropane-1,3-diol trisulfate Traditional Name: 2-methyl-2-methylol-propane-1,3-diol trisulfate Formula: C5H12O15S3-6 MolecularWeight: 408.33478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H12O3.3H2O4S/c1-5(2-6,3-7)4-8;3*1-5(2,3)4/h6-8H,2-4H2,1H3;3*(H2,1,2,3,4)/p-6