| SpectraBase Compound ID | E8fZuc09u7S |
|---|---|
| InChI | InChI=1S/C57H77NO13Si2/c1-12-72(13-2,14-3)70-42-33-43-56(35-66-43,69-37(8)59)48-50(68-52(63)40-31-25-20-26-32-40)57(65)34-41(36(7)44(54(57,9)10)46(60)49(61)55(42,48)11)67-53(64)47(71-73(15-4,16-5)17-6)45(38-27-21-18-22-28-38)58-51(62)39-29-23-19-24-30-39/h18-32,41-43,45-48,50,60,65H,12-17,33-35H2,1-11H3,(H,58,62)/t41-,42-,43+,45-,46+,47+,48?,50-,55+,56-,57+/m0/s1 |
| InChIKey | XEYAPYLENSHPRC-HGECVJHHSA-N |
| Mol Weight | 1040.4 g/mol |
| Molecular Formula | C57H77NO13Si2 |
| Exact Mass | 1039.493345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9fA2IKSpaPn |
|---|---|
| Name | 2',7-BIS-TRIETHYLSILYL-10-DEACETOXYTAXOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H77NO13Si2 |
| InChI | InChI=1S/C57H77NO13Si2/c1-12-72(13-2,14-3)70-42-33-43-56(35-66-43,69-37(8)59)48-50(68-52(63)40-31-25-20-26-32-40)57(65)34-41(36(7)44(54(57,9)10)46(60)49(61)55(42,48)11)67-53(64)47(71-73(15-4,16-5)17-6)45(38-27-21-18-22-28-38)58-51(62)39-29-23-19-24-30-39/h18-32,41-43,45-48,50,60,65H,12-17,33-35H2,1-11H3,(H,58,62)/t41-,42-,43+,45-,46+,47+,48?,50-,55+,56-,57+/m0/s1 |
| InChIKey | XEYAPYLENSHPRC-HGECVJHHSA-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 | 1040.408 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS2435 |