| SpectraBase Compound ID | 9GK2y8Pwsvl |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-25(2)14-15-27(5)16-17-30(24(32)33)19(20(27)18-25)8-9-22-28(6)12-11-23(31)26(3,4)21(28)10-13-29(22,30)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27+,28-,29+,30+/m0/s1 |
| InChIKey | QGOSJBZFTWGWDU-CLZVJAHMSA-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 | KBKauUUoHAD |
|---|---|
| Name | 3-ALPHA-HYDROXYOLEAN-12-EN-27-OIC-ACID |
| CAS Registry Number | 64652-15-9 |
| Compound Number | 3A |
| 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)14-15-27(5)16-17-30(24(32)33)19(20(27)18-25)8-9-22-28(6)12-11-23(31)26(3,4)21(28)10-13-29(22,30)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23+,27+,28-,29+,30+/m0/s1 |
| InChIKey | QGOSJBZFTWGWDU-CLZVJAHMSA-N |
| Literature Reference Author | T.K.CHEN,D.C.ALES,N.C.BAENZIGER,D.F.WIEMER |
| Literature Reference Citation | J.ORG.CHEM.,48,3525(1983) |
| Literature Reference DOI | 10.1021/jo00168a030 |
| Molecular Weight | 456.709 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW11620 |