![#45A;MIXTURE;REL-(2S/R,3R,3A-R/S,4R,6R)-4-BENZOYLOXY-2/3-[2-[DIMETHYL-(1,1,2-TRIMETHYLPROPYL)-SILYLOXY]-1-OXOETHYL]-3/2-(DIMETHYLPHENYLSILYL)-6-[(1S,2R)-(2-PHE](/api/spectrum/1X6qsupmttW/structure.png?h=300&w=458 "#45A;MIXTURE;REL-(2S/R,3R,3A-R/S,4R,6R)-4-BENZOYLOXY-2/3-[2-[DIMETHYL-(1,1,2-TRIMETHYLPROPYL)-SILYLOXY]-1-OXOETHYL]-3/2-(DIMETHYLPHENYLSILYL)-6-[(1S,2R)-(2-PHE")
| SpectraBase Compound ID | 7P9BLpKpuO4 |
|---|---|
| InChI | InChI=1S/2C43H59NO7Si2/c1-30(2)43(3,4)53(7,8)47-29-35(45)40-41(52(5,6)33-24-16-11-17-25-33)39-37(49-42(46)32-22-14-10-15-23-32)28-38(50-44(39)51-40)48-36-27-19-18-26-34(36)31-20-12-9-13-21-31;1-30(2)43(3,4)53(7,8)47-29-35(45)39-40-37(49-41(46)32-22-14-10-15-23-32)28-38(48-36-27-19-18-26-34(36)31-20-12-9-13-21-31)50-44(40)51-42(39)52(5,6)33-24-16-11-17-25-33/h9-17,20-25,30,34,36-41H,18-19,26-29H2,1-8H3;9-17,20-25,30,34,36-40,42H,18-19,26-29H2,1-8H3/t34-,36+,37-,38-,39-,40-,41-;34-,36+,37-,38-,39-,40-,42-/m11/s1 |
| InChIKey | NZZXMTLRFAECRE-SJLQBHGKSA-N |
| Mol Weight | 1516.2 g/mol |
| Molecular Formula | C86H118N2O14Si4 |
| Exact Mass | 1514.766013 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1X6qsupmttW |
|---|---|
| Name | #45A;MIXTURE;REL-(2S/R,3R,3A-R/S,4R,6R)-4-BENZOYLOXY-2/3-[2-[DIMETHYL-(1,1,2-TRIMETHYLPROPYL)-SILYLOXY]-1-OXOETHYL]-3/2-(DIMETHYLPHENYLSILYL)-6-[(1S,2R)-(2-PHE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C86H118N2O14Si4 |
| InChI | InChI=1S/2C43H59NO7Si2/c1-30(2)43(3,4)53(7,8)47-29-35(45)40-41(52(5,6)33-24-16-11-17-25-33)39-37(49-42(46)32-22-14-10-15-23-32)28-38(50-44(39)51-40)48-36-27-19-18-26-34(36)31-20-12-9-13-21-31;1-30(2)43(3,4)53(7,8)47-29-35(45)39-40-37(49-41(46)32-22-14-10-15-23-32)28-38(48-36-27-19-18-26-34(36)31-20-12-9-13-21-31)50-44(40)51-42(39)52(5,6)33-24-16-11-17-25-33/h9-17,20-25,30,34,36-41H,18-19,26-29H2,1-8H3;9-17,20-25,30,34,36-40,42H,18-19,26-29H2,1-8H3/t34-,36+,37-,38-,39-,40-,41-;34-,36+,37-,38-,39-,40-,42-/m11/s1 |
| InChIKey | NZZXMTLRFAECRE-SJLQBHGKSA-N |
| Literature Reference Author | S.E.DENMARK,M.SEIERSTAD,B.HERBERT |
| Literature Reference Citation | J.ORG.CHEM.,64,884(1999) |
| Literature Reference DOI | 10.1021/jo9818374 |
| Molecular Weight | 1516.230 g/mol |
| Sample ID | 39521 |
| Solvent | CDCl3 |