[6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]sulfanyl 2-azanyl-3-sulfanyl-propanoate

Systemtic Name: [6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]sulfanyl 2-azanyl-3-sulfanyl-propanoate Openeye Name: [4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]sulfanyl 2-amino-3-sulfanyl-propanoate CAS Name: 2-amino-3-mercaptopropanoic acid [[4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]thio] ester IUPAC Name: [4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl 2-amino-3-sulfanylpropanoate Traditional Name: 2-amino-3-mercapto-propionic acid [(4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl)thio] ester Formula: C9H17NO6S2 MolecularWeight: 299.36438

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(OC1SOC(=O)C(CS)N)CO)O)O

Isomeric SMILES

C1C(C(C(OC1SOC(=O)C(CS)N)CO)O)O

InChI

InChI=1S/C9H17NO6S2/c10-4(3-17)9(14)16-18-7-1-5(12)8(13)6(2-11)15-7/h4-8,11-13,17H,1-3,10H2