| SpectraBase Compound ID | 3atO9ZCHpC5 |
|---|---|
| InChI | InChI=1S/C30H50O4/c1-18(17-22(31)25(33)27(4,5)34)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,22-23,25,31,33-34H,10-17H2,1-8H3/t18-,19-,20-,22+,23-,25-,28+,29-,30+/m0/s1 |
| InChIKey | DCGUKHULKAAOPB-QBLSGNHRSA-N |
| Mol Weight | 474.7 g/mol |
| Molecular Formula | C30H50O4 |
| Exact Mass | 474.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8G9sGWLjugt |
|---|---|
| Name | 3-OXO-THREO-23,24,25-TRIHYDROXY-TIRUCALL-7-ENE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O4 |
| InChI | InChI=1S/C30H50O4/c1-18(17-22(31)25(33)27(4,5)34)19-11-15-30(8)21-9-10-23-26(2,3)24(32)13-14-28(23,6)20(21)12-16-29(19,30)7/h9,18-20,22-23,25,31,33-34H,10-17H2,1-8H3/t18-,19-,20-,22+,23-,25-,28+,29-,30+/m0/s1 |
| InChIKey | DCGUKHULKAAOPB-QBLSGNHRSA-N |
| Literature Reference Author | A.M.CAMPOS,F.S.OLIVEIRA,M.I.L.MACHADO,R.BRAZ-FILHO,F.J.A.MAT OS |
| Literature Reference Citation | PHYTOCHEM.,30,1225(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95206-3 |
| Molecular Weight | 474.725 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU34225 |