[2-(2-methylheptacosanoyloxy)-3-octacosanoyloxy-propyl] octacosanoate

Systemtic Name: [2-(2-methylheptacosanoyloxy)-3-octacosanoyloxy-propyl] octacosanoate Openeye Name: [2-(2-methylheptacosanoyloxy)-3-octacosanoyloxy-propyl] octacosanoate CAS Name: octacosanoic acid [2-(2-methyl-1-oxoheptacosoxy)-3-(1-oxooctacosoxy)propyl] ester IUPAC Name: [2-(2-methylheptacosanoyloxy)-3-octacosanoyloxypropyl] octacosanoate Traditional Name: montanic acid [2-(2-methylheptacosanoyloxy)-3-octacosanoyloxy-propyl] ester Formula: C87H170O6 MolecularWeight: 1312.2771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C87H170O6/c1-5-8-11-14-17-20-23-26-29-32-35-38-41-43-46-49-52-55-58-61-64-67-70-73-76-79-85(88)91-81-84(93-87(90)83(4)78-75-72-69-66-63-60-57-54-51-48-45-40-37-34-31-28-25-22-19-16-13-10-7-3)82-92-86(89)80-77-74-71-68-65-62-59-56-53-50-47-44-42-39-36-33-30-27-24-21-18-15-12-9-6-2/h83-84H,5-82H2,1-4H3