| SpectraBase Compound ID | LEzFxocOQkz |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-18-19(2)25-20-9-10-23-28(6)13-12-24(32)26(3,4)22(28)11-14-30(23,8)29(20,7)16-15-27(25,5)17-21(18)31/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20?,21-,22?,23?,24+,25?,27+,28+,29-,30-/m1/s1 |
| InChIKey | BRSGFKGWKATOQT-BUSZYHKMSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LnF9RxLelcu |
|---|---|
| Name | 21-ALPHA-HYDROXY-TARAXASTEROL;18-ALPHA,19-ALPHA-URS-20(30)-EN-3-BETA,21-ALPHA-DIOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-18-19(2)25-20-9-10-23-28(6)13-12-24(32)26(3,4)22(28)11-14-30(23,8)29(20,7)16-15-27(25,5)17-21(18)31/h19-25,31-32H,1,9-17H2,2-8H3/t19-,20?,21-,22?,23?,24+,25?,27+,28+,29-,30-/m1/s1 |
| InChIKey | BRSGFKGWKATOQT-BUSZYHKMSA-N |
| Literature Reference Author | S.D.PETROVIC,M.S.GORUNOVIC,V.WRAY,I.MERFORT |
| Literature Reference Citation | PHYTOCHEM.,50,293(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00536-6 |
| Molecular Weight | 442.726 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN11158 |