Wiley SpectraBase; SpectraBase Compound ID=1tNKo8ngAe SpectraBase Spectrum ID=JYEFHuD7BW9
http://spectrabase.com/spectrum/JYEFHuD7BW9 (accessed Oct 21, 2020).

10-DEACTYL-10-TRIDEUTEROACETYLTAXOL
SpectraBase Compound ID 1tNKo8ngAe
InChI InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38?,40-,45+,46-,47+/m0/s1/i2D3
InChIKey RCINICONZNJXQF-IUHVCFBNSA-N
Mol Weight 856.9 g/mol
Molecular Formula C47H482H3NO14
Exact Mass 856.349786 g/mol

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SpectraBase Spectrum ID JYEFHuD7BW9
SpectraBase Batch ID BZJkRGJvFfu
Name 10-DEACTYL-10-TRIDEUTEROACETYLTAXOL
Compound Number 7A
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H482H3NO14
InChI InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38?,40-,45+,46-,47+/m0/s1/i2D3
InChIKey RCINICONZNJXQF-IUHVCFBNSA-N
Literature Reference Author S.H.HOKE,R.G.COOKS,C.J.CHANG,R.C.KELLY,S.J.QUALLS,B.ALVARADO ,M.T.MCGUIRE,K.M.SNA
Literature Reference Citation J.NAT.PROD.,57,277(1994)
Literature Reference DOI 10.1021/np50104a013
Molecular Weight 856.939 g/mol
Solvent CDCl3
Source File Reference UWTS2437
SpectraBase Compound ID 1tNKo8ngAe