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2',3'-O,N-[(S)-(PARA-METHOXYBENZYLIDENE)]-7-O-(TRIETHYLSILYL)-PACLITAXEL
SpectraBase Compound ID IdxEqWKq3TI
InChI InChI=1S/C61H71NO15Si/c1-11-78(12-2,13-3)77-45-33-46-60(35-71-46,76-38(6)64)51-53(75-56(67)42-27-21-16-22-28-42)61(69)34-44(36(4)47(58(61,7)8)49(72-37(5)63)52(65)59(45,51)9)73-57(68)50-48(39-23-17-14-18-24-39)62(54(66)40-25-19-15-20-26-40)55(74-50)41-29-31-43(70-10)32-30-41/h14-32,44-46,48-51,53,55,69H,11-13,33-35H2,1-10H3/t44?,45-,46+,48-,49+,50?,51+,53?,55-,59+,60-,61+/m0/s1
InChIKey CORKWYWJLOSAGE-BHTVFYHNSA-N
Mol Weight 1086.3 g/mol
Molecular Formula C61H71NO15Si
Exact Mass 1085.459297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hlyf0GHUL6P
Name 2',3'-O,N-[(S)-(PARA-METHOXYBENZYLIDENE)]-7-O-(TRIETHYLSILYL)-PACLITAXEL
Compound Number 83
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C61H71NO15Si
InChI InChI=1S/C61H71NO15Si/c1-11-78(12-2,13-3)77-45-33-46-60(35-71-46,76-38(6)64)51-53(75-56(67)42-27-21-16-22-28-42)61(69)34-44(36(4)47(58(61,7)8)49(72-37(5)63)52(65)59(45,51)9)73-57(68)50-48(39-23-17-14-18-24-39)62(54(66)40-25-19-15-20-26-40)55(74-50)41-29-31-43(70-10)32-30-41/h14-32,44-46,48-51,53,55,69H,11-13,33-35H2,1-10H3/t44?,45-,46+,48-,49+,50?,51+,53?,55-,59+,60-,61+/m0/s1
InChIKey CORKWYWJLOSAGE-BHTVFYHNSA-N
Literature Reference Author T.MUKAIYAMA,I.SHIINA,H.IWADARE,M.SAITOH,T.NISHIMURA,N.OHKAWA ,H.SAKOH,K.NISHIMURA
Literature Reference Citation CHEM.EUR.J.,5,121(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19990104)5:1<121::aid-chem121>3.3.co;2-f
Molecular Weight 1086.318 g/mol
Solvent C6D6