2-(2-methylpropylsulfanyloxy)-3,4,5-tris(oxidanyl)pentanal

Systemtic Name: 2-(2-methylpropylsulfanyloxy)-3,4,5-tris(oxidanyl)pentanal Openeye Name: 3,4,5-trihydroxy-2-isobutylsulfanyloxy-pentanal CAS Name: 2-methyl-1-propanesulfenic acid IUPAC Name: 3,4,5-trihydroxy-2-(2-methylpropylsulfanyloxy)pentanal Traditional Name: 3,4,5-trihydroxy-2-(isobutylthio)oxy-valeraldehyde Formula: C9H18O5S MolecularWeight: 238.30122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSOC(C=O)C(C(CO)O)O

Isomeric SMILES

CC(C)CSOC(C=O)C(C(CO)O)O

InChI

InChI=1S/C9H18O5S/c1-6(2)5-15-14-8(4-11)9(13)7(12)3-10/h4,6-10,12-13H,3,5H2,1-2H3