propane-1,2-diol trisulfate

Systemtic Name: propane-1,2-diol trisulfate Openeye Name: propane-1,2-diol trisulfate CAS Name: propane-1,2-diol trisulfate IUPAC Name: propane-1,2-diol trisulfate Traditional Name: propane-1,2-diol trisulfate Formula: C3H8O14S3-6 MolecularWeight: 364.28222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H8O2.3H2O4S/c1-3(5)2-4;3*1-5(2,3)4/h3-5H,2H2,1H3;3*(H2,1,2,3,4)/p-6