| SpectraBase Compound ID | CcdxI7BTWJz |
|---|---|
| InChI | InChI=1S/C41H56O6/c1-26(42)46-28-12-9-27(10-13-28)11-16-34(43)47-33-18-19-38(6)31(37(33,4)5)17-20-40(8)32(38)15-14-29-30-25-36(2,3)21-23-41(30,35(44)45)24-22-39(29,40)7/h9-14,16,30-33H,15,17-25H2,1-8H3,(H,44,45)/b16-11+/t30?,31?,32?,33-,38-,39+,40+,41-/m0/s1 |
| InChIKey | SZPCHCRRJWCDNP-KHOJPVPWSA-N |
| Mol Weight | 644.9 g/mol |
| Molecular Formula | C41H56O6 |
| Exact Mass | 644.40769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6BdwwUWfWhS |
|---|---|
| Name | 3B-(PARA-ACETYLOXY-TRANS-CINNAMOYLOXY)-OLEAN-12-EN-28-OIC_ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H56O6 |
| InChI | InChI=1S/C41H56O6/c1-26(42)46-28-12-9-27(10-13-28)11-16-34(43)47-33-18-19-38(6)31(37(33,4)5)17-20-40(8)32(38)15-14-29-30-25-36(2,3)21-23-41(30,35(44)45)24-22-39(29,40)7/h9-14,16,30-33H,15,17-25H2,1-8H3,(H,44,45)/b16-11+/t30?,31?,32?,33-,38-,39+,40+,41-/m0/s1 |
| InChIKey | SZPCHCRRJWCDNP-KHOJPVPWSA-N |
| Literature Reference Author | L.M.CARVALHO,J.SEITA |
| Literature Reference Citation | PLANTA.MED.,59,369(1993) |
| Literature Reference DOI | 10.1055/s-2006-959704 |
| Molecular Weight | 644.892 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP486 |