[(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis[bis(phenylmethoxy)phosphoryloxy]-2,5,6-tris(methoxymethoxy)cyclohexyl]oxy-methoxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate

Systemtic Name: [(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis[bis(phenylmethoxy)phosphoryloxy]-2,5,6-tris(methoxymethoxy)cyclohexyl]oxy-methoxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate Openeye Name: [(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis(dibenzyloxyphosphoryloxy)-2,5,6-tris(methoxymethoxy)cyclohexoxy]-methoxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis[bis(phenylmethoxy)phosphoryloxy]-2,5,6-tris(methoxymethoxy)cyclohexyl]oxy-methoxyphosphoryl]oxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis[bis(phenylmethoxy)phosphoryloxy]-2,5,6-tris(methoxymethoxy)cyclohexyl]oxy-methoxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate Traditional Name: palmitic acid [(2R)-3-[[(1R,2S,3R,4R,5S,6R)-3,4-bis(dibenzoxyphosphoryloxy)-2,5,6-tris(methoxymethoxy)cyclohexoxy]-methoxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] ester Formula: C76H119O22P3 MolecularWeight: 1477.666143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(OC)OC1C(C(C(C(C1OCOC)OP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)OP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCOC)OCOC)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(OC)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1OCOC)OP(=O)(OCC2=CC=CC=C2)OCC3=CC=CC=C3)OP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCOC)OCOC)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C76H119O22P3/c1-7-9-11-13-15-17-19-21-23-25-27-29-43-53-69(77)86-59-68(95-70(78)54-44-30-28-26-24-22-20-18-16-14-12-10-8-2)60-94-99(79,85-6)96-74-71(87-61-82-3)72(88-62-83-4)75(97-100(80,90-55-64-45-35-31-36-46-64)91-56-65-47-37-32-38-48-65)76(73(74)89-63-84-5)98-101(81,92-57-66-49-39-33-40-50-66)93-58-67-51-41-34-42-52-67/h31-42,45-52,68,71-76H,7-30,43-44,53-63H2,1-6H3/t68-,71-,72+,73+,74-,75-,76-,99?/m1/s1