| SpectraBase Compound ID | 5YAwqZJbTrx |
|---|---|
| InChI | InChI=1S/C36H50O10/c1-8-23-10-9-11-30(44-21(4)37)19(2)32(39)29-17-27-25-15-13-24(16-22(25)12-14-26(27)28(29)18-31(38)45-23)46-36-35(42-7)34(41-6)33(40-5)20(3)43-36/h12-17,19-20,23,26-28,30,32-36,39H,8-11,18H2,1-7H3/t19-,20-,23-,26+,27-,28-,30-,32-,33-,34+,35+,36-/m0/s1 |
| InChIKey | YIEWDBJTXCEJBC-YPQRDDMASA-N |
| Mol Weight | 642.8 g/mol |
| Molecular Formula | C36H50O10 |
| Exact Mass | 642.340398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8SEAyoUq5sb |
|---|---|
| Name | YIEWDBJTXCEJBC-YPQRDDMASA-N |
| Compound Number | (3'S,3A'S,9B'S)-#46 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H50O10 |
| InChI | InChI=1S/C36H50O10/c1-8-23-10-9-11-30(44-21(4)37)19(2)32(39)29-17-27-25-15-13-24(16-22(25)12-14-26(27)28(29)18-31(38)45-23)46-36-35(42-7)34(41-6)33(40-5)20(3)43-36/h12-17,19-20,23,26-28,30,32-36,39H,8-11,18H2,1-7H3/t19-,20-,23-,26+,27-,28-,30-,32-,33-,34+,35+,36-/m0/s1 |
| InChIKey | YIEWDBJTXCEJBC-YPQRDDMASA-N |
| Literature Reference Author | L.F.TIETZE,N.SCHUETZENMEISTER,A.GRUBE,T.SCHFFER,M.M.BAAG,M.G RANITZKA,D.STALKE |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,5748(2012) |
| Literature Reference DOI | 10.1002/ejoc.201200600 |
| Molecular Weight | 642.787 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU83913 |