[(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(2S)-4-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-2,3-bis(triethylsilyloxy)pentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-3-[(1S)-1-methoxy-2-[(4S,5S,6R)-2,2,5-trimethyl-6-[(2R)-1-oxidanylpropan-2-yl]-1,3-dioxan-4-yl]ethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) phosphate

Systemtic Name: [(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(2S)-4-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-2,3-bis(triethylsilyloxy)pentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-3-[(1S)-1-methoxy-2-[(4S,5S,6R)-2,2,5-trimethyl-6-[(2R)-1-oxidanylpropan-2-yl]-1,3-dioxan-4-yl]ethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) phosphate Openeye Name: [(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(1S)-3-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-2,3-bis(triethylsilyloxy)pentanoyl]amino]-1-methyl-propyl]oxazol-4-yl]allyl]-3-[(1S)-2-[(4S,5S,6R)-6-[(1R)-2-hydroxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-methoxy-ethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) phosphate CAS Name: phosphoric acid [(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(2S)-4-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-1-oxo-2,3-bis(triethylsilyloxy)pentyl]amino]butan-2-yl]-4-oxazolyl]prop-2-enyl]-3-[(1S)-2-[(4S,5S,6R)-6-[(2R)-1-hydroxypropan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-methoxyethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) ester IUPAC Name: [(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(2S)-4-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-2,3-bis(triethylsilyloxy)pentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-3-[(1S)-2-[(4S,5S,6R)-6-[(2R)-1-hydroxypropan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-methoxyethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) phosphate Traditional Name: phosphoric acid [(2R,3R,5S,7R,8R,9S)-7-[tert-butyl(dimethyl)silyl]oxy-9-[(E)-3-[2-[(1S)-3-[[(2S,3S,4S)-4-(dimethylamino)-5-methoxy-2,3-bis(triethylsilyloxy)pentanoyl]amino]-1-methyl-propyl]oxazol-4-yl]allyl]-3-[(1S)-2-[(4S,5S,6R)-6-[(1R)-2-hydroxy-1-methyl-ethyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-methoxy-ethyl]-1,1,8-trimethyl-4,10-dioxaspiro[4.5]decan-2-yl] bis(2-trimethylsilylethyl) ester Formula: C70H140N3O16PSi5 MolecularWeight: 1451.272361

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Descriptors Computed from Structure

Canonical SMILES:

CC[Si](CC)(CC)OC(C(COC)N(C)C)C(C(=O)NCCC(C)C1=NC(=CO1)C=CCC2C(C(CC3(O2)C(C(C(O3)C(CC4C(C(OC(O4)(C)C)C(C)CO)C)OC)OP(=O)(OCC[Si](C)(C)C)OCC[Si](C)(C)C)(C)C)O[Si](C)(C)C(C)(C)C)C)O[Si](CC)(CC)CC

Isomeric SMILES

CC[Si](CC)(CC)O[C@@H]([C@H](COC)N(C)C)[C@@H](C(=O)NCC[C@H](C)C1=NC(=CO1)/C=C/C[C@H]2[C@H]([C@@H](C[C@@]3(O2)C([C@H]([C@H](O3)[C@H](C[C@H]4[C@@H]([C@H](OC(O4)(C)C)[C@H](C)CO)C)OC)OP(=O)(OCC[Si](C)(C)C)OCC[Si](C)(C)C)(C)C)O[Si](C)(C)C(C)(C)C)C)O[Si](CC)(CC)CC

InChI

InChI=1S/C70H140N3O16PSi5/c1-30-94(31-2,32-3)88-61(55(49-77-20)73(18)19)63(89-95(33-4,34-5)35-6)65(75)71-40-39-50(7)66-72-54(48-79-66)37-36-38-56-52(9)59(87-93(28,29)67(11,12)13)46-70(83-56)68(14,15)64(86-90(76,80-41-43-91(22,23)24)81-42-44-92(25,26)27)62(85-70)58(78-21)45-57-53(10)60(51(8)47-74)84-69(16,17)82-57/h36-37,48,50-53,55-64,74H,30-35,38-47,49H2,1-29H3,(H,71,75)/b37-36+/t50-,51+,52+,53-,55-,56-,57-,58-,59+,60+,61-,62+,63-,64-,70-/m0/s1