| SpectraBase Compound ID | 6stSlYYU2N9 |
|---|---|
| InChI | InChI=1S/C35H46O6/c1-21(2)12-15-26-30(37)24-10-7-8-11-25(24)31(38)32(26)41-29(36)20-22(3)13-16-27-23(4)14-17-28-34(27,5)18-9-19-35(28,6)33(39)40/h7-8,10-12,22-23,27-28H,9,13-20H2,1-6H3,(H,39,40)/t22-,23+,27+,28-,34-,35+/m1/s1 |
| InChIKey | UEIMCJAZPSZZRG-PVYFKFMPSA-N |
| Mol Weight | 562.7 g/mol |
| Molecular Formula | C35H46O6 |
| Exact Mass | 562.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69cLEqYmlO4 |
|---|---|
| Name | LAPACHOYL-17-BETA-DIHYDROJUNICEDRATE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H46O6 |
| InChI | InChI=1S/C35H46O6/c1-21(2)12-15-26-30(37)24-10-7-8-11-25(24)31(38)32(26)41-29(36)20-22(3)13-16-27-23(4)14-17-28-34(27,5)18-9-19-35(28,6)33(39)40/h7-8,10-12,22-23,27-28H,9,13-20H2,1-6H3,(H,39,40)/t22-,23+,27+,28-,34-,35+/m1/s1 |
| InChIKey | UEIMCJAZPSZZRG-PVYFKFMPSA-N |
| Literature Reference Author | M.W.PERTINO,C.THEODULOZ,J.A.PALENZUELA,M.DELMARAFONSO,E.YESI LADA,F.MONSALVE,P.GO |
| Literature Reference Citation | MOLECULES,16,8614(2011) |
| Literature Reference DOI | 10.3390/molecules16108614 |
| Molecular Weight | 562.747 g/mol |
| Sample ID | 324 |
| Solvent | CDCl3 |