| SpectraBase Compound ID | AlP9L6Ibrxh |
|---|---|
| InChI | InChI=1S/C49H63NO8/c1-9-20-41-35(5)46(52)50(48(6,56-41)37-23-12-10-13-24-37)28-19-18-22-33(3)45-34(4)42(57-49(7,58-45)38-25-14-11-15-26-38)27-17-16-21-32(2)43-30-36-29-39(54-8)31-40(51)44(36)47(53)55-43/h10-19,23-26,29,31-35,41-43,45,51H,9,20-22,27-28,30H2,1-8H3/b17-16-,19-18-/t32-,33-,34-,35+,41-,42+,43+,45-,48?,49+/m0/s1 |
| InChIKey | XFZDDASHVBDVHY-HRYJHENVSA-N |
| Mol Weight | 794.0 g/mol |
| Molecular Formula | C49H63NO8 |
| Exact Mass | 793.455368 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F5Ro25F1Bpm |
|---|---|
| Name | CRUENTAREN-B-BISACETAL |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H63NO8 |
| InChI | InChI=1S/C49H63NO8/c1-9-20-41-35(5)46(52)50(48(6,56-41)37-23-12-10-13-24-37)28-19-18-22-33(3)45-34(4)42(57-49(7,58-45)38-25-14-11-15-26-38)27-17-16-21-32(2)43-30-36-29-39(54-8)31-40(51)44(36)47(53)55-43/h10-19,23-26,29,31-35,41-43,45,51H,9,20-22,27-28,30H2,1-8H3/b17-16-,19-18-/t32-,33-,34-,35+,41-,42+,43+,45-,48?,49+/m0/s1 |
| InChIKey | XFZDDASHVBDVHY-HRYJHENVSA-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 | 794.041 g/mol |
| Sample ID | 44354 |
| Solvent | CDCl3 |