| SpectraBase Compound ID | 4GAh7AhnRZg |
|---|---|
| InChI | InChI=1S/C37H54O10/c1-21(38)45-20-34(6)27-12-13-36(8)28(33(27,5)19-26(46-22(2)39)29(34)47-23(3)40)11-10-24-25-18-32(4,31(43)44-9)14-16-37(25,30(41)42)17-15-35(24,36)7/h10,25-29H,11-20H2,1-9H3,(H,41,42)/t25-,26?,27?,28?,29?,32+,33?,34?,35+,36?,37-/m1/s1 |
| InChIKey | YCNGUYRTSWRKTL-CPFQGMTKSA-N |
| Mol Weight | 658.8 g/mol |
| Molecular Formula | C37H54O10 |
| Exact Mass | 658.371698 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IEqCwXHKLtw |
|---|---|
| Name | 2.beta.,3.beta.,23-Triacetyl-30.beta.-methyloleanate-12-en-28-oic-acid |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C37H54O10 |
| InChI | InChI=1S/C37H54O10/c1-21(38)45-20-34(6)27-12-13-36(8)28(33(27,5)19-26(46-22(2)39)29(34)47-23(3)40)11-10-24-25-18-32(4,31(43)44-9)14-16-37(25,30(41)42)17-15-35(24,36)7/h10,25-29H,11-20H2,1-9H3,(H,41,42)/t25-,26?,27?,28?,29?,32+,33?,34?,35+,36?,37-/m1/s1 |
| InChIKey | YCNGUYRTSWRKTL-CPFQGMTKSA-N |
| Instrument Name | SF = 100 MHz |
| Literature Reference | Phytochem. 23, 2893 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |