4,4-bis(hydroxymethyl)-5-oxidanyl-pentane-1-sulfonic acid

Systemtic Name: 4,4-bis(hydroxymethyl)-5-oxidanyl-pentane-1-sulfonic acid Openeye Name: 5-hydroxy-4,4-bis(hydroxymethyl)pentane-1-sulfonic acid CAS Name: 5-hydroxy-4,4-bis(hydroxymethyl)-1-pentanesulfonic acid IUPAC Name: 5-hydroxy-4,4-bis(hydroxymethyl)pentane-1-sulfonic acid Traditional Name: 5-hydroxy-4,4-dimethylol-pentane-1-sulfonic acid Formula: C7H16O6S MolecularWeight: 228.26334

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(CO)(CO)CO)CS(=O)(=O)O

Isomeric SMILES

C(CC(CO)(CO)CO)CS(=O)(=O)O

InChI

InChI=1S/C7H16O6S/c8-4-7(5-9,6-10)2-1-3-14(11,12)13/h8-10H,1-6H2,(H,11,12,13)