3,3-bis(hydroxymethyl)-2-methyl-5-oxidanyl-2-sulfanyl-pentanoate

Systemtic Name: 3,3-bis(hydroxymethyl)-2-methyl-5-oxidanyl-2-sulfanyl-pentanoate Openeye Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-methyl-2-sulfanyl-pentanoate CAS Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-mercapto-2-methylpentanoate IUPAC Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-methyl-2-sulfanylpentanoate Traditional Name: 5-hydroxy-2-mercapto-2-methyl-3,3-dimethylol-valerate Formula: C8H15O5S- MolecularWeight: 223.2667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])(C(CCO)(CO)CO)S

Isomeric SMILES

CC(C(=O)[O-])(C(CCO)(CO)CO)S

InChI

InChI=1S/C8H16O5S/c1-7(14,6(12)13)8(4-10,5-11)2-3-9/h9-11,14H,2-5H2,1H3,(H,12,13)/p-1