[3-acetyloxy-2-(hexacosanoylamino)-1-oxidanyl-octadecan-4-yl] ethanoate

Systemtic Name: [3-acetyloxy-2-(hexacosanoylamino)-1-oxidanyl-octadecan-4-yl] ethanoate Openeye Name: 1-[1-acetoxy-2-(hexacosanoylamino)-3-hydroxy-propyl]pentadecyl acetate CAS Name: acetic acid [3-acetyloxy-1-hydroxy-2-(1-oxohexacosylamino)octadecan-4-yl] ester IUPAC Name: [3-acetyloxy-2-(hexacosanoylamino)-1-hydroxyoctadecan-4-yl] acetate Traditional Name: acetic acid 1-[1-acetoxy-2-(hexacosanoylamino)-3-hydroxy-propyl]pentadecyl ester Formula: C48H93NO6 MolecularWeight: 780.25512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(C(CCCCCCCCCCCCCC)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(C(CCCCCCCCCCCCCC)OC(=O)C)OC(=O)C

InChI

InChI=1S/C48H93NO6/c1-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-47(53)49-45(42-50)48(55-44(4)52)46(54-43(3)51)40-38-36-34-32-30-18-16-14-12-10-8-6-2/h45-46,48,50H,5-42H2,1-4H3,(H,49,53)