| SpectraBase Compound ID | 17HOzjmUw5z |
|---|---|
| InChI | InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,19-20,23-27,30H,8-9,11-18H2,1-6H3/b21-7-/t20-,23+,24?,25?,26?,27?,28+,29-/m1/s1/i2+1,3+1 |
| InChIKey | OSELKOCHBMDKEJ-HMMOSKTCSA-N |
| Mol Weight | 414.7 g/mol |
| Molecular Formula | C2713C2H48O |
| Exact Mass | 414.377226 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 58dgzBvqXfI |
|---|---|
| Name | ISOFUCOSTEROL;PRO-R-(13)C-ISOFUCOSTEROL |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O |
| InChI | InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,19-20,23-27,30H,8-9,11-18H2,1-6H3/b21-7-/t20-,23+,24?,25?,26?,27?,28+,29-/m1/s1/i2+1,3+1 |
| InChIKey | OSELKOCHBMDKEJ-HMMOSKTCSA-N |
| Literature Reference Author | K.NASU,K.TAKAHASHI,M.MORISAKI,Y.FUJIMOTO |
| Literature Reference Citation | PHYTOCHEM.,54,381(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00122-9 |
| Molecular Weight | 412.700 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1307 |