[2-[2-[2,3-bis(oxidanyl)propyl]-3,4-di(octanoyloxy)oxolan-2-yl]-2-octanoyloxy-4,5-bis(oxidanyl)pentyl] octanoate

Systemtic Name: [2-[2-[2,3-bis(oxidanyl)propyl]-3,4-di(octanoyloxy)oxolan-2-yl]-2-octanoyloxy-4,5-bis(oxidanyl)pentyl] octanoate Openeye Name: [2-[2-(2,3-dihydroxypropyl)-3,4-di(octanoyloxy)tetrahydrofuran-2-yl]-4,5-dihydroxy-2-octanoyloxy-pentyl] octanoate CAS Name: octanoic acid [2-[2-(2,3-dihydroxypropyl)-3,4-bis(1-oxooctoxy)-2-oxolanyl]-4,5-dihydroxy-2-(1-oxooctoxy)pentyl] ester IUPAC Name: [2-[2-(2,3-dihydroxypropyl)-3,4-di(octanoyloxy)oxolan-2-yl]-4,5-dihydroxy-2-octanoyloxypentyl] octanoate Traditional Name: caprylic acid [2-caprylyloxy-2-(3,4-dicaprylyloxy-2-glyceryl-tetrahydrofuran-2-yl)-4,5-dihydroxy-pentyl] ester Formula: C44H80O13 MolecularWeight: 817.0982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(CC(CO)O)(C1(C(C(CO1)OC(=O)CCCCCCC)OC(=O)CCCCCCC)CC(CO)O)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OCC(CC(CO)O)(C1(C(C(CO1)OC(=O)CCCCCCC)OC(=O)CCCCCCC)CC(CO)O)OC(=O)CCCCCCC

InChI

InChI=1S/C44H80O13/c1-5-9-13-17-21-25-38(49)53-34-43(29-35(47)31-45,57-41(52)28-24-20-16-12-8-4)44(30-36(48)32-46)42(56-40(51)27-23-19-15-11-7-3)37(33-54-44)55-39(50)26-22-18-14-10-6-2/h35-37,42,45-48H,5-34H2,1-4H3