| SpectraBase Compound ID | Bh29BbM4yUG |
|---|---|
| InChI | InChI=1S/C37H52O5/c1-23(2)25-14-19-36(32(40)41)20-21-37(22-42-31(39)24-10-8-7-9-11-24)26(30(25)36)12-13-28-34(5)17-16-29(38)33(3,4)27(34)15-18-35(28,37)6/h7-11,25-30,38H,1,12-22H2,2-6H3,(H,40,41)/t25-,26+,27-,28+,29-,30+,34-,35+,36-,37-/m0/s1 |
| InChIKey | UOOCKKIJUDJHOV-OZLSVLHISA-N |
| Mol Weight | 576.8 g/mol |
| Molecular Formula | C37H52O5 |
| Exact Mass | 576.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 163dEOzjxgo |
|---|---|
| Name | 3-BETA-HYDROXY-27-BENZOYLOXY-LUP-20(29)-EN-28-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H52O5 |
| InChI | InChI=1S/C37H52O5/c1-23(2)25-14-19-36(32(40)41)20-21-37(22-42-31(39)24-10-8-7-9-11-24)26(30(25)36)12-13-28-34(5)17-16-29(38)33(3,4)27(34)15-18-35(28,37)6/h7-11,25-30,38H,1,12-22H2,2-6H3,(H,40,41)/t25-,26+,27-,28+,29-,30+,34-,35+,36-,37-/m0/s1 |
| InChIKey | UOOCKKIJUDJHOV-OZLSVLHISA-N |
| Literature Reference Author | W.CHEN,W.TANG,L.LOU,W.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,67,1041(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.03.005 |
| Molecular Weight | 576.817 g/mol |
| Sample ID | 66269 |
| Solvent | CDCl3 |