[2-[1,1-di(dodecanoyloxy)-2-oxidanyl-ethyl]-2-dodecanoyloxy-3-dodecanoylperoxy-4-oxidanyl-oxolan-3-yl] dodecanoate

Systemtic Name: [2-[1,1-di(dodecanoyloxy)-2-oxidanyl-ethyl]-2-dodecanoyloxy-3-dodecanoylperoxy-4-oxidanyl-oxolan-3-yl] dodecanoate Openeye Name: [2-[1,1-di(dodecanoyloxy)-2-hydroxy-ethyl]-2-dodecanoyloxy-3-dodecanoylperoxy-4-hydroxy-tetrahydrofuran-3-yl] dodecanoate CAS Name: dodecanoic acid [4-hydroxy-2-[2-hydroxy-1,1-bis(1-oxododecoxy)ethyl]-2-(1-oxododecoxy)-3-(1-oxododecyldioxy)-3-oxolanyl] ester IUPAC Name: [2-[1,1-di(dodecanoyloxy)-2-hydroxyethyl]-2-dodecanoyloxy-3-dodecanoylperoxy-4-hydroxyoxolan-3-yl] dodecanoate Traditional Name: lauric acid [4-hydroxy-2-(2-hydroxy-1,1-dilauroyloxy-ethyl)-2-lauroyloxy-3-lauroylperoxy-tetrahydrofuran-3-yl] ester Formula: C66H122O14 MolecularWeight: 1139.66648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1(C(COC1(C(CO)(OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)O)OOC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1(C(COC1(C(CO)(OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)O)OOC(=O)CCCCCCCCCCC

InChI

InChI=1S/C66H122O14/c1-6-11-16-21-26-31-36-41-46-51-59(69)75-64(57-67,76-60(70)52-47-42-37-32-27-22-17-12-7-2)66(78-62(72)54-49-44-39-34-29-24-19-14-9-4)65(58(68)56-74-66,77-61(71)53-48-43-38-33-28-23-18-13-8-3)80-79-63(73)55-50-45-40-35-30-25-20-15-10-5/h58,67-68H,6-57H2,1-5H3