| SpectraBase Compound ID | DHjV6suec4p |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19-,21?,22-,23?,24-,27?,28-,29+,30-/m1/s1 |
| InChIKey | WCGUUGGRBIKTOS-CVJDGADDSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ywBQQtpY9A |
|---|---|
| Name | Ursolic-acid |
| CAS Registry Number | 77-52-1 |
| Comments | APT, DEPT, INE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)/t18-,19-,21?,22-,23?,24-,27?,28-,29+,30-/m1/s1 |
| InChIKey | WCGUUGGRBIKTOS-CVJDGADDSA-N |
| Instrument Name | SF = 400 MHz |
| Literature Reference | Phytochem. 25, 1939 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |