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

Systemtic Name: 5-(2-methylpropylsulfanyl)-2,3,4-tris(oxidanyl)pentanal Openeye Name: 2,3,4-trihydroxy-5-isobutylsulfanyl-pentanal CAS Name: 2,3,4-trihydroxy-5-(2-methylpropylthio)pentanal IUPAC Name: 2,3,4-trihydroxy-5-(2-methylpropylsulfanyl)pentanal Traditional Name: 2,3,4-trihydroxy-5-(isobutylthio)valeraldehyde Formula: C9H18O4S MolecularWeight: 222.30182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCC(C(C(C=O)O)O)O

Isomeric SMILES

CC(C)CSCC(C(C(C=O)O)O)O

InChI

InChI=1S/C9H18O4S/c1-6(2)4-14-5-8(12)9(13)7(11)3-10/h3,6-9,11-13H,4-5H2,1-2H3