2-[2,3-bis(oxidanyl)propyl]-2,3-di(hexadecanoyl)butanedioic acid

Systemtic Name: 2-[2,3-bis(oxidanyl)propyl]-2,3-di(hexadecanoyl)butanedioic acid Openeye Name: 2-(2,3-dihydroxypropyl)-2,3-di(hexadecanoyl)butanedioic acid CAS Name: 2-(2,3-dihydroxypropyl)-2,3-bis(1-oxohexadecyl)butanedioic acid IUPAC Name: 2-(2,3-dihydroxypropyl)-2,3-di(hexadecanoyl)butanedioic acid Traditional Name: 2-glyceryl-2,3-di(hexadecanoyl)succinic acid Formula: C39H72O8 MolecularWeight: 668.98418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(=O)O)C(CC(CO)O)(C(=O)CCCCCCCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(=O)O)C(CC(CO)O)(C(=O)CCCCCCCCCCCCCCC)C(=O)O

InChI

InChI=1S/C39H72O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)36(37(44)45)39(38(46)47,31-33(41)32-40)35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36,40-41H,3-32H2,1-2H3,(H,44,45)(H,46,47)