| SpectraBase Compound ID | 2P1q1ZKCTRi |
|---|---|
| InChI | InChI=1S/C30H48O2/c1-19(2)16-21(31)17-20(3)22-10-12-28(7)24-9-8-23-26(4,5)25(32)11-13-29(23)18-30(24,29)15-14-27(22,28)6/h16,20,22-25,32H,8-15,17-18H2,1-7H3/t20-,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1 |
| InChIKey | SHDLDZAFCBVGKJ-IVUVJCJMSA-N |
| Mol Weight | 440.7 g/mol |
| Molecular Formula | C30H48O2 |
| Exact Mass | 440.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Y8k2qIATbJ |
|---|---|
| Name | 3-BETA-HYDROXY-5-ALPHA-CYCLOART-24-EN-23-ONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O2 |
| InChI | InChI=1S/C30H48O2/c1-19(2)16-21(31)17-20(3)22-10-12-28(7)24-9-8-23-26(4,5)25(32)11-13-29(23)18-30(24,29)15-14-27(22,28)6/h16,20,22-25,32H,8-15,17-18H2,1-7H3/t20-,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1 |
| InChIKey | SHDLDZAFCBVGKJ-IVUVJCJMSA-N |
| Literature Reference Author | H.ACHENBACH,D.FREY |
| Literature Reference Citation | PHYTOCHEM.,31,4263(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80456-O |
| Molecular Weight | 440.710 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN26708 |