[(1R,3S,4S,6S)-2,3-bis[bis(phenylmethoxy)phosphoryloxy]-5-oxidanyl-4,6-bis(phenylmethoxymethoxy)cyclohexyl] bis(phenylmethyl) phosphate

Systemtic Name: [(1R,3S,4S,6S)-2,3-bis[bis(phenylmethoxy)phosphoryloxy]-5-oxidanyl-4,6-bis(phenylmethoxymethoxy)cyclohexyl] bis(phenylmethyl) phosphate Openeye Name: dibenzyl [(1R,2S,4S,5S)-2,4-bis(benzyloxymethoxy)-5,6-bis(dibenzyloxyphosphoryloxy)-3-hydroxy-cyclohexyl] phosphate CAS Name: phosphoric acid [(1R,3S,4S,6S)-2,3-bis[bis(phenylmethoxy)phosphoryloxy]-5-hydroxy-4,6-bis(phenylmethoxymethoxy)cyclohexyl] bis(phenylmethyl) ester IUPAC Name: dibenzyl [(1R,3S,4S,6S)-2,3-bis[bis(phenylmethoxy)phosphoryloxy]-5-hydroxy-4,6-bis(phenylmethoxymethoxy)cyclohexyl] phosphate Traditional Name: phosphoric acid dibenzyl [(1R,2S,4S,5S)-2,4-bis(benzoxymethoxy)-5,6-bis(dibenzoxyphosphoryloxy)-3-hydroxy-cyclohexyl] ester Formula: C64H67O17P3 MolecularWeight: 1201.127863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCOC2C(C(C(C(C2OP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4)OP(=O)(OCC5=CC=CC=C5)OCC6=CC=CC=C6)OP(=O)(OCC7=CC=CC=C7)OCC8=CC=CC=C8)OCOCC9=CC=CC=C9)O

Isomeric SMILES

C1=CC=C(C=C1)COCO[C@@H]2[C@H](C([C@H]([C@H](C2O)OCOCC3=CC=CC=C3)OP(=O)(OCC4=CC=CC=C4)OCC5=CC=CC=C5)OP(=O)(OCC6=CC=CC=C6)OCC7=CC=CC=C7)OP(=O)(OCC8=CC=CC=C8)OCC9=CC=CC=C9

InChI

InChI=1S/C64H67O17P3/c65-59-60(71-49-69-41-51-25-9-1-10-26-51)62(79-82(66,73-43-53-29-13-3-14-30-53)74-44-54-31-15-4-16-32-54)64(81-84(68,77-47-57-37-21-7-22-38-57)78-48-58-39-23-8-24-40-58)63(61(59)72-50-70-42-52-27-11-2-12-28-52)80-83(67,75-45-55-33-17-5-18-34-55)76-46-56-35-19-6-20-36-56/h1-40,59-65H,41-50H2/t59?,60-,61-,62-,63+,64?/m0/s1