| SpectraBase Compound ID | 61uDb45uFqa |
|---|---|
| InChI | InChI=1S/C40H46O13/c1-20(2)39-30(49-33(43)25-15-11-9-12-16-25)22(4)40-27-19-21(3)29(47-23(5)41)38(27,46)35(50-34(44)26-17-13-10-14-18-26)36(7,45)31(48-24(6)42)28(40)32(39)51-37(8,52-39)53-40/h9-18,21-22,27-32,35,45-46H,1,19H2,2-8H3/t21-,22+,27+,28-,29-,30-,31-,32+,35+,36+,37?,38+,39-,40-/m0/s1 |
| InChIKey | YRHRFRAGMYDVMA-MQTLPGEGSA-N |
| Mol Weight | 734.8 g/mol |
| Molecular Formula | C40H46O13 |
| Exact Mass | 734.293842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6QBEOtP6q |
|---|---|
| Name | TRIGOHOWNIN-E |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H46O13 |
| InChI | InChI=1S/C40H46O13/c1-20(2)39-30(49-33(43)25-15-11-9-12-16-25)22(4)40-27-19-21(3)29(47-23(5)41)38(27,46)35(50-34(44)26-17-13-10-14-18-26)36(7,45)31(48-24(6)42)28(40)32(39)51-37(8,52-39)53-40/h9-18,21-22,27-32,35,45-46H,1,19H2,2-8H3/t21-,22+,27+,28-,29-,30-,31-,32+,35+,36+,37?,38+,39-,40-/m0/s1 |
| InChIKey | YRHRFRAGMYDVMA-MQTLPGEGSA-N |
| Literature Reference Author | H.B.WANG,L.P.LIU,X.Y.WANG |
| Literature Reference Citation | MAGN.RES.CHEM.,51,580(2013) |
| Literature Reference DOI | 10.1002/mrc.3978 |
| Molecular Weight | 734.797 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR13473 |