| SpectraBase Compound ID | J7Kel0NgJFf |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27-,28+,29+,30-/m0/s1 |
| InChIKey | MIJYXULNPSFWEK-KDQGZELNSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7WMEkGMVXGo |
|---|---|
| Name | 3-ALPHA-HYDROXY-OLEAN-12-EN-28-OIC-ACID;3-EPI-OLEANOLIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27-,28+,29+,30-/m0/s1 |
| InChIKey | MIJYXULNPSFWEK-KDQGZELNSA-N |
| Literature Reference Author | B.N.IRUNGU,J.A.ORWA,A.GRUNHONJIC,P.A.FITZPATRICK,G.LANDBERG, F.KIMANI,J.MIDIWO |
| Literature Reference Citation | MOLECULES,19,14235(2014) |
| Literature Reference DOI | 10.3390/molecules190914235 |
| Molecular Weight | 456.709 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWIR15367 |