| SpectraBase Compound ID | C5XjkaD70il |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,4)11-10-22-28(21,5)15-17-30(7)23-18-26(3,24(32)33)13-12-25(23,2)14-16-29(22,30)6/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21-,22+,23-,25+,26-,27+,28-,29+,30-/m0/s1 |
| InChIKey | WHWHDGKOSUKYOV-YLFNMIGUSA-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 | FTEuSCY5z5o |
|---|---|
| Name | 3-OXO-D:A-FRIEDOOLEANAN-30-OIC_ACID;OCTANDRONIC_ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-19-20(31)8-9-21-27(19,4)11-10-22-28(21,5)15-17-30(7)23-18-26(3,24(32)33)13-12-25(23,2)14-16-29(22,30)6/h19,21-23H,8-18H2,1-7H3,(H,32,33)/t19-,21-,22+,23-,25+,26-,27+,28-,29+,30-/m0/s1 |
| InChIKey | WHWHDGKOSUKYOV-YLFNMIGUSA-N |
| Literature Reference Author | E.M.O.YEBOAH,R.R.T.MAJINDA,A.KADZIOLA,A.MULLER |
| Literature Reference Citation | J.NAT.PROD.,73,1151(2010) |
| Literature Reference DOI | 10.1021/np900597w |
| Molecular Weight | 456.709 g/mol |
| Sample ID | 35734 |
| Solvent | CDCl3 |