| SpectraBase Compound ID | 5pVP7X38DUM |
|---|---|
| InChI | InChI=1S/C31H48O4/c1-19(32)35-25-12-13-28(6)22(27(25,4)5)11-14-29(7)23(28)10-9-20-21-17-26(2,3)15-16-31(21,34)24(33)18-30(20,29)8/h9,21-23,25,34H,10-18H2,1-8H3/t21-,22?,23?,25?,28?,29?,30+,31+/m1/s1 |
| InChIKey | AEDAQQXVOVRYMI-AANQJWOKSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C31H48O4 |
| Exact Mass | 484.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48XwDpaPcJE |
|---|---|
| Name | 3.beta.-Acetyl-17-hydroxy-28-norolean-12-en-16-one |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H48O4 |
| InChI | InChI=1S/C31H48O4/c1-19(32)35-25-12-13-28(6)22(27(25,4)5)11-14-29(7)23(28)10-9-20-21-17-26(2,3)15-16-31(21,34)24(33)18-30(20,29)8/h9,21-23,25,34H,10-18H2,1-8H3/t21-,22?,23?,25?,28?,29?,30+,31+/m1/s1 |
| InChIKey | AEDAQQXVOVRYMI-AANQJWOKSA-N |
| Instrument Name | SF = 080 MHz |
| Literature Reference | Phytochem. 23, 639 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |