| SpectraBase Compound ID | JQCSDkRt7Ce |
|---|---|
| InChI | InChI=1S/C33H51NO8/c1-7-12-26(35)22(4)32(39)34-16-11-10-14-21(3)31(38)23(5)29-15-9-8-13-20(2)27(36)18-24-17-25(41-6)19-28(37)30(24)33(40)42-29/h8-11,17,19-23,26-27,29,31,35-38H,7,12-16,18H2,1-6H3,(H,34,39)/b9-8-,11-10-/t20-,21-,22+,23+,26-,27+,29-,31+/m0/s1 |
| InChIKey | UXPPKIOUXFFKDI-WKBLFHPKSA-N |
| Mol Weight | 589.8 g/mol |
| Molecular Formula | C33H51NO8 |
| Exact Mass | 589.361468 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LKcFxrKMh5P |
|---|---|
| Name | CRUENTAREN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H51NO8 |
| InChI | InChI=1S/C33H51NO8/c1-7-12-26(35)22(4)32(39)34-16-11-10-14-21(3)31(38)23(5)29-15-9-8-13-20(2)27(36)18-24-17-25(41-6)19-28(37)30(24)33(40)42-29/h8-11,17,19-23,26-27,29,31,35-38H,7,12-16,18H2,1-6H3,(H,34,39)/b9-8-,11-10-/t20-,21-,22+,23+,26-,27+,29-,31+/m0/s1 |
| InChIKey | UXPPKIOUXFFKDI-WKBLFHPKSA-N |
| Literature Reference Author | L.JUNDT,H.STEINMETZ,P.LUGER,M.WEBER,B.KUNZE,H.REICHENBACH,G. HOEFLE |
| Literature Reference Citation | EUR.J.ORG.CHEM.,5036(2006) |
| Molecular Weight | 589.770 g/mol |
| Sample ID | 44352 |
| Solvent | CDCl3 |