[(5aS,6R,7S,8R,9R,9aS)-9-oxidanyl-2,2,4,4-tetra(propan-2-yl)-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-bis(oxidanyl)propyl] methyl phosphate

Systemtic Name: [(5aS,6R,7S,8R,9R,9aS)-9-oxidanyl-2,2,4,4-tetra(propan-2-yl)-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-bis(oxidanyl)propyl] methyl phosphate Openeye Name: [(5aS,6R,7S,8R,9R,9aS)-9-hydroxy-2,2,4,4-tetraisopropyl-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-dihydroxypropyl] methyl phosphate CAS Name: phosphoric acid [(5aS,6R,7S,8R,9R,9aS)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-dihydroxypropyl] methyl ester IUPAC Name: [(5aS,6R,7S,8R,9R,9aS)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-dihydroxypropyl] methyl phosphate Traditional Name: phosphoric acid [(5aS,6R,7S,8R,9R,9aS)-9-hydroxy-2,2,4,4-tetraisopropyl-6,8-bis[[(2R,3S,4S,5R,6R)-3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]oxy]-5a,6,7,8,9,9a-hexahydrobenzo[f][1,3,5,2,4]trioxadisilepin-7-yl] [(2R)-2,3-dihydroxypropyl] methyl ester Formula: C90H115O22PSi2 MolecularWeight: 1636.007661

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si]1(OC2C(C(C(C(C2O[Si](O1)(C(C)C)C(C)C)OC3C(C(C(C(O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OP(=O)(OC)OCC(CO)O)OC8C(C(C(C(O8)COCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)O)C(C)C

Isomeric SMILES

CC(C)[Si]1(O[C@H]2[C@@H]([C@H]([C@@H]([C@@H]([C@@H]2O[Si](O1)(C(C)C)C(C)C)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)COCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7)O[P@@](=O)(OC)OC[C@@H](CO)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)COCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)O)C(C)C

InChI

InChI=1S/C90H115O22PSi2/c1-62(2)114(63(3)4)110-81-77(93)80(107-89-87(102-57-72-46-30-16-31-47-72)82(100-55-70-42-26-14-27-43-70)78(98-53-68-38-22-12-23-39-68)75(105-89)60-96-51-66-34-18-10-19-35-66)85(109-113(94,95-9)104-59-74(92)50-91)84(86(81)111-115(112-114,64(5)6)65(7)8)108-90-88(103-58-73-48-32-17-33-49-73)83(101-56-71-44-28-15-29-45-71)79(99-54-69-40-24-13-25-41-69)76(106-90)61-97-52-67-36-20-11-21-37-67/h10-49,62-65,74-93H,50-61H2,1-9H3/t74-,75-,76-,77-,78-,79-,80-,81+,82+,83+,84+,85+,86-,87+,88+,89-,90-,113+/m1/s1