| SpectraBase Compound ID | BbPjoSAlSkx |
|---|---|
| InChI | InChI=1S/C25H34O9/c1-10(2)6-15(27)34-17-19-24(5)21(30)16(28)18-23(4)12(11(3)7-13(26)20(23)29)8-14(33-22(17)31)25(18,19)9-32-24/h7,10,12,14,16-21,28-30H,6,8-9H2,1-5H3/t12-,14?,16+,17+,18+,19-,20+,21-,23-,24-,25+/m0/s1 |
| InChIKey | KYZOEAVZQJUNIL-AGVGIFBOSA-N |
| Mol Weight | 478.5 g/mol |
| Molecular Formula | C25H34O9 |
| Exact Mass | 478.220283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8gZVJPnK7Kk |
|---|---|
| Name | CEDRONOLACTONE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O9 |
| InChI | InChI=1S/C25H34O9/c1-10(2)6-15(27)34-17-19-24(5)21(30)16(28)18-23(4)12(11(3)7-13(26)20(23)29)8-14(33-22(17)31)25(18,19)9-32-24/h7,10,12,14,16-21,28-30H,6,8-9H2,1-5H3/t12-,14?,16+,17+,18+,19-,20+,21-,23-,24-,25+/m0/s1 |
| InChIKey | KYZOEAVZQJUNIL-AGVGIFBOSA-N |
| Literature Reference Author | A.OZEKI,Y.HITOTSUYANAGI,E.HASHIMOTO,H.ITOKAWA,K.TAKEYA,S.D.M .ALVES |
| Literature Reference Citation | J.NAT.PROD.,61,776(1998) |
| Literature Reference DOI | 10.1021/np980023f |
| Molecular Weight | 478.540 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP554 |