[2,3,4,5,6-penta(octadecanoyloxy)cyclohexyl] octadecanoate

Systemtic Name: [2,3,4,5,6-penta(octadecanoyloxy)cyclohexyl] octadecanoate Openeye Name: [2,3,4,5,6-penta(octadecanoyloxy)cyclohexyl] octadecanoate CAS Name: octadecanoic acid [2,3,4,5,6-pentakis(1-oxooctadecoxy)cyclohexyl] ester IUPAC Name: [2,3,4,5,6-penta(octadecanoyloxy)cyclohexyl] octadecanoate Traditional Name: stearic acid (2,3,4,5,6-pentastearoyloxycyclohexyl) ester Formula: C114H216O12 MolecularWeight: 1778.92764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(C(C1OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(C(C1OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C114H216O12/c1-7-13-19-25-31-37-43-49-55-61-67-73-79-85-91-97-103(115)121-109-110(122-104(116)98-92-86-80-74-68-62-56-50-44-38-32-26-20-14-8-2)112(124-106(118)100-94-88-82-76-70-64-58-52-46-40-34-28-22-16-10-4)114(126-108(120)102-96-90-84-78-72-66-60-54-48-42-36-30-24-18-12-6)113(125-107(119)101-95-89-83-77-71-65-59-53-47-41-35-29-23-17-11-5)111(109)123-105(117)99-93-87-81-75-69-63-57-51-45-39-33-27-21-15-9-3/h109-114H,7-102H2,1-6H3