| SpectraBase Compound ID | 9D4F3WJ4wHU |
|---|---|
| InChI | InChI=1S/C35H52O8/c1-20(36)42-24-19-32(6)25(30(3,4)27(24)43-21(2)37)12-13-34(8)26(32)11-10-22-23-18-31(5,28(38)39)14-16-35(23,29(40)41-9)17-15-33(22,34)7/h10,23-27H,11-19H2,1-9H3,(H,38,39)/t23-,24?,25?,26?,27?,31+,32?,33+,34?,35-/m1/s1 |
| InChIKey | MJDZBNALIXFJEX-FIIHWFAKSA-N |
| Mol Weight | 600.8 g/mol |
| Molecular Formula | C35H52O8 |
| Exact Mass | 600.366219 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J5UVEg52FBW |
|---|---|
| Name | 2.beta.,3.beta.-Diacetyl-30.beta.-oleanatic-acid-12-en-28.beta.-carboxymethylester |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C35H52O8 |
| InChI | InChI=1S/C35H52O8/c1-20(36)42-24-19-32(6)25(30(3,4)27(24)43-21(2)37)12-13-34(8)26(32)11-10-22-23-18-31(5,28(38)39)14-16-35(23,29(40)41-9)17-15-33(22,34)7/h10,23-27H,11-19H2,1-9H3,(H,38,39)/t23-,24?,25?,26?,27?,31+,32?,33+,34?,35-/m1/s1 |
| InChIKey | MJDZBNALIXFJEX-FIIHWFAKSA-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 |