[3,4,5-tri(dodecanoyloxy)-6-oxidanyl-oxan-2-yl]methyl dodecanoate

Systemtic Name: [3,4,5-tri(dodecanoyloxy)-6-oxidanyl-oxan-2-yl]methyl dodecanoate Openeye Name: [3,4,5-tri(dodecanoyloxy)-6-hydroxy-tetrahydropyran-2-yl]methyl dodecanoate CAS Name: dodecanoic acid [6-hydroxy-3,4,5-tris(1-oxododecoxy)-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tri(dodecanoyloxy)-6-hydroxyoxan-2-yl]methyl dodecanoate Traditional Name: lauric acid (6-hydroxy-3,4,5-trilauroyloxy-tetrahydropyran-2-yl)methyl ester Formula: C54H100O10 MolecularWeight: 909.3658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)O)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)O)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C54H100O10/c1-5-9-13-17-21-25-29-33-37-41-47(55)60-45-46-51(62-48(56)42-38-34-30-26-22-18-14-10-6-2)52(63-49(57)43-39-35-31-27-23-19-15-11-7-3)53(54(59)61-46)64-50(58)44-40-36-32-28-24-20-16-12-8-4/h46,51-54,59H,5-45H2,1-4H3