| SpectraBase Compound ID | KZQwcqMuJLJ |
|---|---|
| InChI | InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,18-19,21-24,32-34,36H,11-13H2,1-5H3/t18-,19+,21+,22-,23-,24-,27+,28-,29+/m0/s1 |
| InChIKey | VGYGMYOFCJDRPE-UANCLEHBSA-N |
| Mol Weight | 544.6 g/mol |
| Molecular Formula | C29H36O10 |
| Exact Mass | 544.230847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3nnRZC63WDZ |
|---|---|
| Name | TAXUSPINANANE-C |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O10 |
| InChI | InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,18-19,21-24,32-34,36H,11-13H2,1-5H3/t18-,19+,21+,22-,23-,24-,27+,28-,29+/m0/s1 |
| InChIKey | VGYGMYOFCJDRPE-UANCLEHBSA-N |
| Literature Reference Author | H.MORITA,L.WEI,A.GONDA,K.TAKEYA,H.ITOKAWA |
| Literature Reference Citation | PHYTOCHEM.,46,583(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00308-7 |
| Molecular Weight | 544.599 g/mol |
| Sample ID | 44912 |
| Solvent | CDCl3 |