| SpectraBase Compound ID | ITPYx4eud0f |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-27(2)23-10-13-32(7)25(30(23,5)12-11-24(27)33)22(35-8)18-20-21-19-29(4,26(34)36-9)15-14-28(21,3)16-17-31(20,32)6/h18,21-23,25H,10-17,19H2,1-9H3/t21-,22+,23-,25+,28+,29-,30-,31+,32+/m0/s1 |
| InChIKey | QPDGKYGOXACXMF-GQENXVRPSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JpHLTYAOB3u |
|---|---|
| Name | 3-OXO-11-ALPHA-METHOXYOLEAN-12-ENE-30-OIC-ACID-METHYLESTER |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-27(2)23-10-13-32(7)25(30(23,5)12-11-24(27)33)22(35-8)18-20-21-19-29(4,26(34)36-9)15-14-28(21,3)16-17-31(20,32)6/h18,21-23,25H,10-17,19H2,1-9H3/t21-,22+,23-,25+,28+,29-,30-,31+,32+/m0/s1 |
| InChIKey | QPDGKYGOXACXMF-GQENXVRPSA-N |
| Literature Reference Author | I.MUHAMMAD,K.A.ELSAYED,J.S.MOSSA,M.S.AL-SAID,F.S.EL-FERALY,A .M.CLARK,C.D.HUFFORD |
| Literature Reference Citation | J.NAT.PROD.,63,605(2000) |
| Literature Reference DOI | 10.1021/np990456y |
| Molecular Weight | 498.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU5778 |