| SpectraBase Compound ID | ZqCz0aShdx |
|---|---|
| InChI | InChI=1S/C31H52O3/c1-26(2)17-20-19-16-21(34-9)25-29(6)12-11-23(32)27(3,4)22(29)10-13-31(25,8)30(19,7)15-14-28(20,5)18-24(26)33/h16,20-25,32-33H,10-15,17-18H2,1-9H3/t20-,21+,22-,23+,24-,25+,28-,29-,30+,31+/m0/s1 |
| InChIKey | JEJMNORHOUMHQX-PXOODBAWSA-N |
| Mol Weight | 472.8 g/mol |
| Molecular Formula | C31H52O3 |
| Exact Mass | 472.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 28gTK7gNFUG |
|---|---|
| Name | 3-ALPHA,21-BETA-DIHYDROXY-11-ALPHA-METHOXY-OLEAN-12-ENE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O3 |
| InChI | InChI=1S/C31H52O3/c1-26(2)17-20-19-16-21(34-9)25-29(6)12-11-23(32)27(3,4)22(29)10-13-31(25,8)30(19,7)15-14-28(20,5)18-24(26)33/h16,20-25,32-33H,10-15,17-18H2,1-9H3/t20-,21+,22-,23+,24-,25+,28-,29-,30+,31+/m0/s1 |
| InChIKey | JEJMNORHOUMHQX-PXOODBAWSA-N |
| Literature Reference Author | D.CACERES-CASTILLO,G.J.MENA-REJON,R.CEDILLO-RIVERA,L.QUIJANO |
| Literature Reference Citation | PHYTOCHEM.,69,1057(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.10.016 |
| Molecular Weight | 472.752 g/mol |
| Sample ID | 43287 |
| Solvent | CDCl3 |