2-ethoxy-5-octadecoxy-4-oxidanyl-pentanethioic S-acid

Systemtic Name: 2-ethoxy-5-octadecoxy-4-oxidanyl-pentanethioic S-acid Openeye Name: 2-ethoxy-4-hydroxy-5-octadecoxy-pentanethioic S-acid CAS Name: 2-ethoxy-4-hydroxy-5-octadecoxypentanethioic S-acid IUPAC Name: 2-ethoxy-4-hydroxy-5-octadecoxypentanethioic S-acid Traditional Name: 2-ethoxy-4-hydroxy-5-stearyloxy-thiovaleric acid Formula: C25H50O4S MolecularWeight: 446.7271

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CC(C(=O)S)OCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CC(C(=O)S)OCC)O

InChI

InChI=1S/C25H50O4S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-22-23(26)21-24(25(27)30)29-4-2/h23-24,26H,3-22H2,1-2H3,(H,27,30)