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

Systemtic Name: 3,3-bis(hydroxymethyl)-2-methyl-5-oxidanyl-2-sulfanyl-pentanoic acid Openeye Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-methyl-2-sulfanyl-pentanoic acid CAS Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-mercapto-2-methylpentanoic acid IUPAC Name: 5-hydroxy-3,3-bis(hydroxymethyl)-2-methyl-2-sulfanylpentanoic acid Traditional Name: 5-hydroxy-2-mercapto-2-methyl-3,3-dimethylol-valeric acid Formula: C8H16O5S MolecularWeight: 224.27464

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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)