[(1R,2S)-2-(hexadecanoyloxymethyl)-3-(hydroxymethyl)cyclopropyl]methyl hexadecanoate

Systemtic Name: [(1R,2S)-2-(hexadecanoyloxymethyl)-3-(hydroxymethyl)cyclopropyl]methyl hexadecanoate Openeye Name: [(1R,2S)-2-(hexadecanoyloxymethyl)-3-(hydroxymethyl)cyclopropyl]methyl hexadecanoate CAS Name: hexadecanoic acid [(1R,3S)-2-(hydroxymethyl)-3-(1-oxohexadecoxymethyl)cyclopropyl]methyl ester IUPAC Name: [(1R,2S)-2-(hexadecanoyloxymethyl)-3-(hydroxymethyl)cyclopropyl]methyl hexadecanoate Traditional Name: palmitic acid [(1R,2S)-2-(hexadecanoyloxymethyl)-3-methylol-cyclopropyl]methyl ester Formula: C38H72O5 MolecularWeight: 608.97528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1C(C1COC(=O)CCCCCCCCCCCCCCC)CO

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@@H](C1CO)COC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C38H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(40)42-32-35-34(31-39)36(35)33-43-38(41)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34-36,39H,3-33H2,1-2H3/t34?,35-,36+