| SpectraBase Compound ID | H2iKS6zI97T |
|---|---|
| InChI | InChI=1S/C23H34O9/c1-10(2)20(26)30-17-15-13(6)22(28)31-18(15)19(32-21(27)11(3)4)23(7,29)14(24)9-8-12(5)16(17)25/h10-12,15-19,25,29H,6,8-9H2,1-5,7H3/t12-,15-,16-,17-,18+,19-,23+/m1/s1 |
| InChIKey | WTBKTSVQJQEIHA-DQWWWAKVSA-N |
| Mol Weight | 454.5 g/mol |
| Molecular Formula | C23H34O9 |
| Exact Mass | 454.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GAhlnzCp2yF |
|---|---|
| Name | 4-BETA,9-BETA-DIHYDROXY-5-BETA,8-ALPHA-DI-(ISOBUTYRYLOXY)-3-OXO-GERMACRAN-7-BETA,12-ALPHA-OLIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H34O9 |
| InChI | InChI=1S/C23H34O9/c1-10(2)20(26)30-17-15-13(6)22(28)31-18(15)19(32-21(27)11(3)4)23(7,29)14(24)9-8-12(5)16(17)25/h10-12,15-19,25,29H,6,8-9H2,1-5,7H3/t12-,15-,16-,17-,18+,19-,23+/m1/s1 |
| InChIKey | WTBKTSVQJQEIHA-DQWWWAKVSA-N |
| Literature Reference Author | X.GAO,C.J.LIN,Z.J.JIA |
| Literature Reference Citation | J.NAT.PROD.,70,830(2007) |
| Literature Reference DOI | 10.1021/np0700570 |
| Molecular Weight | 454.518 g/mol |
| Sample ID | 30313 |
| Solvent | CD3OD |