| SpectraBase Compound ID | GNMZ7C7g0Ki |
|---|---|
| InChI | InChI=1S/C43H50N4O7/c1-51-29-9-5-7-27-32(29)47-23-38(18-24-19-40-21-31(48)54-30(40)10-14-45-16-12-42(27,36(40)45)43(24,47)50)22-46-15-11-41-26-6-3-4-8-28(26)44-33(41)25(34(49)52-2)20-39(35(41)46)13-17-53-37(38)39/h3-9,24-25,30,33,35-37,44,50H,10-23H2,1-2H3/t24-,25-,30+,33+,35+,36+,37+,38+,39+,40+,41+,42?,43-/m1/s1 |
| InChIKey | KTAGDNNMBODOKC-HKSKZFKZSA-N |
| Mol Weight | 734.9 g/mol |
| Molecular Formula | C43H50N4O7 |
| Exact Mass | 734.36795 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Mf2RSg1TsU |
|---|---|
| Name | 2-BETA,16-BETA-DIHYDROVOBTUSINE-LACTONE |
| CAS Registry Number | 59796-71-3 |
| Compound Number | 1E |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H50N4O7 |
| InChI | InChI=1S/C43H50N4O7/c1-51-29-9-5-7-27-32(29)47-23-38(18-24-19-40-21-31(48)54-30(40)10-14-45-16-12-42(27,36(40)45)43(24,47)50)22-46-15-11-41-26-6-3-4-8-28(26)44-33(41)25(34(49)52-2)20-39(35(41)46)13-17-53-37(38)39/h3-9,24-25,30,33,35-37,44,50H,10-23H2,1-2H3/t24-,25-,30+,33+,35+,36+,37+,38+,39+,40+,41+,42?,43-/m1/s1 |
| InChIKey | KTAGDNNMBODOKC-HKSKZFKZSA-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 | 734.893 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK2493 |