| SpectraBase Compound ID | 3X9woPXTMWg |
|---|---|
| InChI | InChI=1S/C28H44O4/c1-17-8-13-27(31-16-17)18(2)24-26(4)12-10-22-21(23(26)15-28(24,30-5)32-27)7-6-19-14-20(29)9-11-25(19,22)3/h6,17-18,20-24,29H,7-16H2,1-5H3/t17-,18+,20+,21?,22?,23?,24?,25+,26+,27+,28-/m0/s1 |
| InChIKey | LQIGIHFYLJKHAH-NGXQAZSCSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C28H44O4 |
| Exact Mass | 444.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6j4JMOssrVb |
|---|---|
| Name | BETHOGENIN |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C28H44O4 |
| InChI | InChI=1S/C28H44O4/c1-17-8-13-27(31-16-17)18(2)24-26(4)12-10-22-21(23(26)15-28(24,30-5)32-27)7-6-19-14-20(29)9-11-25(19,22)3/h6,17-18,20-24,29H,7-16H2,1-5H3/t17-,18+,20+,21?,22?,23?,24?,25+,26+,27+,28-/m0/s1 |
| InChIKey | LQIGIHFYLJKHAH-NGXQAZSCSA-N |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |