| SpectraBase Compound ID | 4MOh6AV9KXk |
|---|---|
| InChI | InChI=1S/C43H52N4O6/c1-50-30-9-5-7-28-32(30)47-24-38(20-25-21-39-13-18-52-31(39)10-15-45-17-12-42(28,36(39)45)43(25,47)49)23-46-16-11-41-27-6-3-4-8-29(27)44-33(41)26(34(48)51-2)22-40(35(41)46)14-19-53-37(38)40/h3-9,25-26,31,33,35-37,44,49H,10-24H2,1-2H3/t25-,26-,31+,33+,35+,36+,37+,38+,39-,40+,41+,42-,43-/m1/s1 |
| InChIKey | VRZATVOONOBXHV-VKWUYZCDSA-N |
| Mol Weight | 720.9 g/mol |
| Molecular Formula | C43H52N4O6 |
| Exact Mass | 720.388685 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HQ7CTFGaaKi |
|---|---|
| Name | 2-BETA,16-BETA-DIHYDROVOBTUSINE |
| CAS Registry Number | 59803-47-3 |
| Compound Number | 1D |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H52N4O6 |
| InChI | InChI=1S/C43H52N4O6/c1-50-30-9-5-7-28-32(30)47-24-38(20-25-21-39-13-18-52-31(39)10-15-45-17-12-42(28,36(39)45)43(25,47)49)23-46-16-11-41-27-6-3-4-8-29(27)44-33(41)26(34(48)51-2)22-40(35(41)46)14-19-53-37(38)40/h3-9,25-26,31,33,35-37,44,49H,10-24H2,1-2H3/t25-,26-,31+,33+,35+,36+,37+,38+,39-,40+,41+,42-,43-/m1/s1 |
| InChIKey | VRZATVOONOBXHV-VKWUYZCDSA-N |
| Literature Reference Author | Y.ROLLAND,N.KUNESCH,J.POISSON,E.W.HAGAMAN,F.M.SCHELL,E.WENKE RT |
| Literature Reference Citation | J.ORG.CHEM.,41,3270(1976) |
| Literature Reference DOI | 10.1021/jo00882a013 |
| Molecular Weight | 720.909 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK2492 |