| SpectraBase Compound ID | Ixji9hVytoG |
|---|---|
| InChI | InChI=1S/C30H40O4/c1-18-19-8-10-28(4)21(20(19)16-22(31)24(18)32)9-11-29(5)23-17-27(3,25(33)34-7)13-12-26(23,2)14-15-30(28,29)6/h8-10,16,23,31-32H,11-15,17H2,1-7H3/t23?,26-,27-,28-,29+,30-/m1/s1 |
| InChIKey | ZNQFUVKAKSTVGH-YHVBHYLCSA-N |
| Mol Weight | 464.6 g/mol |
| Molecular Formula | C30H40O4 |
| Exact Mass | 464.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNMzLBijO2j |
|---|---|
| Name | ISOPRISTIMERIN-III |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O4 |
| InChI | InChI=1S/C30H40O4/c1-18-19-8-10-28(4)21(20(19)16-22(31)24(18)32)9-11-29(5)23-17-27(3,25(33)34-7)13-12-26(23,2)14-15-30(28,29)6/h8-10,16,23,31-32H,11-15,17H2,1-7H3/t23?,26-,27-,28-,29+,30-/m1/s1 |
| InChIKey | ZNQFUVKAKSTVGH-YHVBHYLCSA-N |
| Literature Reference Author | H.ITOKAWA,O.SHIROTA,H.IKUTA,H.MORITA,K.TAKEYA,Y.IITAKA |
| Literature Reference Citation | PHYTOCHEM.,30,3713(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)80096-J |
| Molecular Weight | 464.645 g/mol |
| Solvent | CDCl3:CD3OD=2:1 |
| Source File Reference | UWMS27056 |