[4,5-di(hexadecanoyloxy)-3,6-bis(oxidanyl)oxan-2-yl]methyl hexadecanoate

Systemtic Name: [4,5-di(hexadecanoyloxy)-3,6-bis(oxidanyl)oxan-2-yl]methyl hexadecanoate Openeye Name: [4,5-di(hexadecanoyloxy)-3,6-dihydroxy-tetrahydropyran-2-yl]methyl hexadecanoate CAS Name: hexadecanoic acid [3,6-dihydroxy-4,5-bis(1-oxohexadecoxy)-2-oxanyl]methyl ester IUPAC Name: [4,5-di(hexadecanoyloxy)-3,6-dihydroxyoxan-2-yl]methyl hexadecanoate Traditional Name: palmitic acid [4,5-di(hexadecanoyloxy)-3,6-dihydroxy-tetrahydropyran-2-yl]methyl ester Formula: C54H102O9 MolecularWeight: 895.38228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)O)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)O)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)O

InChI

InChI=1S/C54H102O9/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-48(55)60-46-47-51(58)52(62-49(56)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)53(54(59)61-47)63-50(57)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h47,51-54,58-59H,4-46H2,1-3H3