| SpectraBase Compound ID | 7SVpFgUiDGz |
|---|---|
| InChI | InChI=1S/C74H120N6O12Si3/c1-47(2)41-64(77-69(82)67(92-95(54(15)16,55(17)18)56(19)20)42-57-34-37-61(38-35-57)90-93(48(3)4,49(5)6)50(7)8)70(83)80-65-44-62(91-94(51(9)10,52(11)12)53(13)14)39-36-60(65)43-66(80)68(81)76-63(71(84)87-21)33-28-40-79(74(86)89-46-59-31-26-23-27-32-59)72(75)78-73(85)88-45-58-29-24-22-25-30-58/h22-27,29-32,34-35,37-38,47-56,60,62-67H,28,33,36,39-46H2,1-21H3,(H,76,81)(H,77,82)(H2,75,78,85)/t60-,62+,63+,64+,65-,66-,67+/m0/s1 |
| InChIKey | ANNFYXNJSUCFAO-MYSOMGMQSA-N |
| Mol Weight | 1370.1 g/mol |
| Molecular Formula | C74H120N6O12Si3 |
| Exact Mass | 1368.827203 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tvEgfZH5Bl |
|---|---|
| Name | TIPS-O-D-HPLA(TIPS)-D-LEU-L-CHOI(TIPS)-L-ARG(DELTA,OMEGA'-DI-CBZ)-OME |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C74H120N6O12Si3 |
| InChI | InChI=1S/C74H120N6O12Si3/c1-47(2)41-64(77-69(82)67(92-95(54(15)16,55(17)18)56(19)20)42-57-34-37-61(38-35-57)90-93(48(3)4,49(5)6)50(7)8)70(83)80-65-44-62(91-94(51(9)10,52(11)12)53(13)14)39-36-60(65)43-66(80)68(81)76-63(71(84)87-21)33-28-40-79(74(86)89-46-59-31-26-23-27-32-59)72(75)78-73(85)88-45-58-29-24-22-25-30-58/h22-27,29-32,34-35,37-38,47-56,60,62-67H,28,33,36,39-46H2,1-21H3,(H,76,81)(H,77,82)(H2,75,78,85)/t60-,62+,63+,64+,65-,66-,67+/m0/s1 |
| InChIKey | ANNFYXNJSUCFAO-MYSOMGMQSA-N |
| Literature Reference Author | T.OHSHIMA.V.GNANADESIKAN,T.SHIBUGUCHHI,Y.FUKUTA,T.NEMOTO,M.S HIBASAKI |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,11206(2003) |
| Literature Reference DOI | 10.1021/ja037290e |
| Molecular Weight | 1370.056 g/mol |
| Sample ID | 50515 |
| Solvent | CDCl3 |