| SpectraBase Compound ID | 5nyzYkxlO9S |
|---|---|
| InChI | InChI=1S/C31H46O5/c1-25(2)19-8-12-28(5)20(27(19,4)11-10-22(25)32)9-13-31-21-16-26(3,24(34)35-7)14-15-30(21,18-36-31)23(33)17-29(28,31)6/h10-11,19-21,23,33H,8-9,12-18H2,1-7H3/t19-,20-,21-,23+,26-,27-,28+,29-,30-,31+/m0/s1 |
| InChIKey | LBYTXZMJBKKQRJ-UFUKDAAASA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C31H46O5 |
| Exact Mass | 498.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HBgFOLtgdB5 |
|---|---|
| Name | 13.beta.-28-Epoxy-16.alpha.-hydroxy-3-oxo-olean-2-en-30-oic-acid, methylester |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C31H46O5 |
| InChI | InChI=1S/C31H46O5/c1-25(2)19-8-12-28(5)20(27(19,4)11-10-22(25)32)9-13-31-21-16-26(3,24(34)35-7)14-15-30(21,18-36-31)23(33)17-29(28,31)6/h10-11,19-21,23,33H,8-9,12-18H2,1-7H3/t19-,20-,21-,23+,26-,27-,28+,29-,30-,31+/m0/s1 |
| InChIKey | LBYTXZMJBKKQRJ-UFUKDAAASA-N |
| Instrument Name | SF = 090 MHz |
| Literature Reference | Phytochem. 24, 1203 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |