| SpectraBase Compound ID | 4P2dmoxoSCf |
|---|---|
| InChI | InChI=1S/C22H31NO6/c1-4-13-17-16(12(3)19(25)29-17)22(27)10-14(15-9-11(2)18(24)28-15)23-8-6-5-7-21(13,22)20(23)26/h11-17,27H,4-10H2,1-3H3/t11-,12+,13-,14-,15-,16-,17-,21-,22-/m0/s1 |
| InChIKey | YOBIPOVYJKVGIS-QHSDLTJRSA-N |
| Mol Weight | 405.49 g/mol |
| Molecular Formula | C22H31NO6 |
| Exact Mass | 405.215138 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TETtDPp7H2 |
|---|---|
| Name | TUBEROSTEMONINOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H31NO6 |
| InChI | InChI=1S/C22H31NO6/c1-4-13-17-16(12(3)19(25)29-17)22(27)10-14(15-9-11(2)18(24)28-15)23-8-6-5-7-21(13,22)20(23)26/h11-17,27H,4-10H2,1-3H3/t11-,12+,13-,14-,15-,16-,17-,21-,22-/m0/s1 |
| InChIKey | YOBIPOVYJKVGIS-QHSDLTJRSA-N |
| Literature Reference Author | W.H.LIN,L.MA,M.S.CAI,R.A.BARNES |
| Literature Reference Citation | PHYTOCHEM.,36,1333(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89662-4 |
| Molecular Weight | 405.491 g/mol |
| Solvent | DMSO |
| Source File Reference | UWLU26344 |