[(2R,3S,4S,5R)-6-dodecanoyloxy-3,4-bis(oxidanyl)-2,5-bis(phenylmethoxy)hexyl] dodecanoate

Systemtic Name: [(2R,3S,4S,5R)-6-dodecanoyloxy-3,4-bis(oxidanyl)-2,5-bis(phenylmethoxy)hexyl] dodecanoate Openeye Name: [(2R,3S,4S,5R)-2,5-dibenzyloxy-6-dodecanoyloxy-3,4-dihydroxy-hexyl] dodecanoate CAS Name: dodecanoic acid [(2R,3S,4S,5R)-3,4-dihydroxy-6-(1-oxododecoxy)-2,5-bis(phenylmethoxy)hexyl] ester IUPAC Name: [(2R,3S,4S,5R)-6-dodecanoyloxy-3,4-dihydroxy-2,5-bis(phenylmethoxy)hexyl] dodecanoate Traditional Name: lauric acid [(2R,3S,4S,5R)-2,5-dibenzoxy-3,4-dihydroxy-6-lauroyloxy-hexyl] ester Formula: C44H70O8 MolecularWeight: 727.0218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(C(C(C(COC(=O)CCCCCCCCCCC)OCC1=CC=CC=C1)O)O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCC(=O)OC[C@H]([C@H]([C@@H]([C@@H](COC(=O)CCCCCCCCCCC)OCC1=CC=CC=C1)O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C44H70O8/c1-3-5-7-9-11-13-15-17-25-31-41(45)51-35-39(49-33-37-27-21-19-22-28-37)43(47)44(48)40(50-34-38-29-23-20-24-30-38)36-52-42(46)32-26-18-16-14-12-10-8-6-4-2/h19-24,27-30,39-40,43-44,47-48H,3-18,25-26,31-36H2,1-2H3/t39-,40-,43-,44-/m1/s1