[(2R)-1-oxidanylidene-1-[[(2S,3R)-3-oxidanyl-1-[(2S,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-octadecan-2-yl]amino]tetracosan-2-yl] ethanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[(2S,3R)-3-oxidanyl-1-[(2S,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy-octadecan-2-yl]amino]tetracosan-2-yl] ethanoate Openeye Name: [(1R)-1-[[(1S,2R)-2-hydroxy-1-[[(2S,3R,4S,5S,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]oxymethyl]heptadecyl]carbamoyl]tricosyl] acetate CAS Name: acetic acid [(2R)-1-[[(2S,3R)-3-hydroxy-1-[[(2S,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]oxy]octadecan-2-yl]amino]-1-oxotetracosan-2-yl] ester IUPAC Name: [(2R)-1-[[(2S,3R)-3-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxyoctadecan-2-yl]amino]-1-oxotetracosan-2-yl] acetate Traditional Name: acetic acid [(1R)-1-[[(1S,2R)-2-hydroxy-1-[[(2S,3R,4S,5S,6R)-3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]oxymethyl]heptadecyl]carbamoyl]tricosyl] ester Formula: C78H121NO10 MolecularWeight: 1232.79604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)C(CCCCCCCCCCCCCCC)O)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](CO[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)[C@@H](CCCCCCCCCCCCCCC)O)OC(=O)C

InChI

InChI=1S/C78H121NO10/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-26-28-30-32-34-48-58-72(88-65(3)80)77(82)79-70(71(81)57-47-33-31-29-27-25-17-15-13-11-9-7-5-2)63-87-78-76(86-62-69-55-45-38-46-56-69)75(85-61-68-53-43-37-44-54-68)74(84-60-67-51-41-36-42-52-67)73(89-78)64-83-59-66-49-39-35-40-50-66/h35-46,49-56,70-76,78,81H,4-34,47-48,57-64H2,1-3H3,(H,79,82)/t70-,71+,72+,73+,74-,75-,76+,78-/m0/s1