| SpectraBase Compound ID | 3I3VR4FUDp3 |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-7-19(17(2)3)14-25(31)18(4)22-8-9-23-27-24(11-13-29(22,23)6)28(5)12-10-21(30)15-20(28)16-26(27)32/h16-19,21-27,30-32H,7-15H2,1-6H3/t18-,19-,21-,22?,23-,24-,25-,26+,27-,28-,29+/m0/s1 |
| InChIKey | NZSAHCYFUVNLPX-OYCYGMIJSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C29H50O3 |
| Exact Mass | 446.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L3CUX8qhy8I |
|---|---|
| Name | STIGMAST-5-ENE-3-BETA,7-ALPHA,22-ALPHA-TRIOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-7-19(17(2)3)14-25(31)18(4)22-8-9-23-27-24(11-13-29(22,23)6)28(5)12-10-21(30)15-20(28)16-26(27)32/h16-19,21-27,30-32H,7-15H2,1-6H3/t18-,19-,21-,22?,23-,24-,25-,26+,27-,28-,29+/m0/s1 |
| InChIKey | NZSAHCYFUVNLPX-OYCYGMIJSA-N |
| Literature Reference Author | Y.LI,M.ISHIBASHI,M.SATAKE,X.CHEN,Y.OSHIMA,Y.OHIZUMI |
| Literature Reference Citation | J.NAT.PROD.,66,696(2003) |
| Literature Reference DOI | 10.1021/np020577p |
| Molecular Weight | 446.714 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI7789 |