| SpectraBase Compound ID | FoJHsQfdWOf |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(28(20,5)11-10-22(25)31)8-7-18-19-17-27(4,23(32)33)14-13-26(19,3)15-16-30(18,29)24(34)35/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20-,21+,22+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | QEZXREBSGZAJJO-NDELSYEPSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JCqevuzgV14 |
|---|---|
| Name | 3-ALPHA-HYDROXYOLEAN-12-ENE-27,29-DIOIC-ACID |
| CAS Registry Number | 86727-53-9 |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(28(20,5)11-10-22(25)31)8-7-18-19-17-27(4,23(32)33)14-13-26(19,3)15-16-30(18,29)24(34)35/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20-,21+,22+,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | QEZXREBSGZAJJO-NDELSYEPSA-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 | 486.692 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW11632 |