methyl (3S,5R)-2-hexyl-3,5-bis(oxidanyl)hexadecanoate

Systemtic Name: methyl (3S,5R)-2-hexyl-3,5-bis(oxidanyl)hexadecanoate Openeye Name: methyl (3S,5R)-2-hexyl-3,5-dihydroxy-hexadecanoate CAS Name: (3S,5R)-2-hexyl-3,5-dihydroxyhexadecanoic acid methyl ester IUPAC Name: methyl (3S,5R)-2-hexyl-3,5-dihydroxyhexadecanoate Traditional Name: (3S,5R)-2-hexyl-3,5-dihydroxy-palmitic acid methyl ester Formula: C23H46O4 MolecularWeight: 386.60894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)OC)O)O

Isomeric SMILES

CCCCCCCCCCC[C@H](C[C@@H](C(CCCCCC)C(=O)OC)O)O

InChI

InChI=1S/C23H46O4/c1-4-6-8-10-11-12-13-14-15-17-20(24)19-22(25)21(23(26)27-3)18-16-9-7-5-2/h20-22,24-25H,4-19H2,1-3H3/t20-,21?,22+/m1/s1