| SpectraBase Compound ID | 3qfa5fjjXod |
|---|---|
| InChI | InChI=1S/C27H40O3/c1-16-13-18(28)14-17-15-21-26(5)10-7-19-24(2,3)22(29)9-11-25(19,4)20(26)8-12-27(21,6)30-23(16)17/h13-14,19-22,28-29H,7-12,15H2,1-6H3/t19-,20?,21?,22-,25-,26+,27-/m0/s1 |
| InChIKey | LRMHPGVONLYGQD-LWRLGYOKSA-N |
| Mol Weight | 412.6 g/mol |
| Molecular Formula | C27H40O3 |
| Exact Mass | 412.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Clxy40jE5SH |
|---|---|
| Name | TAONDIOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O3 |
| InChI | InChI=1S/C27H40O3/c1-16-13-18(28)14-17-15-21-26(5)10-7-19-24(2,3)22(29)9-11-25(19,4)20(26)8-12-27(21,6)30-23(16)17/h13-14,19-22,28-29H,7-12,15H2,1-6H3/t19-,20?,21?,22-,25-,26+,27-/m0/s1 |
| InChIKey | LRMHPGVONLYGQD-LWRLGYOKSA-N |
| Literature Reference Author | M.WESSLES,G.M.KOENIG,A.D.WRIGHT |
| Literature Reference Citation | J.NAT.PROD.,62,927(1999) |
| Literature Reference DOI | 10.1021/np990010h |
| Molecular Weight | 412.613 g/mol |
| Solvent | CDCl3 |
| Source File Reference | WANG2 |