| SpectraBase Compound ID | JvUgefU3oDm |
|---|---|
| InChI | InChI=1S/C27H42O3/c1-16(2)12-19(29)13-17(3)21-6-7-22-20-15-25(30)24-14-18(28)8-10-27(24,5)23(20)9-11-26(21,22)4/h9,12,17-18,20-22,24-25,28,30H,6-8,10-11,13-15H2,1-5H3/t17-,18+,20+,21-,22+,24-,25+,26-,27-/m1/s1 |
| InChIKey | JMTGPYQQNHOZAL-GNGILNPGSA-N |
| Mol Weight | 414.6 g/mol |
| Molecular Formula | C27H42O3 |
| Exact Mass | 414.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KsOZr54cXz7 |
|---|---|
| Name | 3-BETA,6-ALPHA-DIHYDROXY-5-ALPHA-CHOLESTA-9(11),24-DIEN-23-ONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O3 |
| InChI | InChI=1S/C27H42O3/c1-16(2)12-19(29)13-17(3)21-6-7-22-20-15-25(30)24-14-18(28)8-10-27(24,5)23(20)9-11-26(21,22)4/h9,12,17-18,20-22,24-25,28,30H,6-8,10-11,13-15H2,1-5H3/t17-,18+,20+,21-,22+,24-,25+,26-,27-/m1/s1 |
| InChIKey | JMTGPYQQNHOZAL-GNGILNPGSA-N |
| Literature Reference Author | T.KOMORI,H.C.KREBS,Y.ITAKURA,R.HIGUCHI,K.SAKAMOTO,S.TAGUCHI, T.KAWASAKI |
| Literature Reference Citation | LIEB.ANN.CHEM.,2092(1983) |
| Molecular Weight | 414.629 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK1344 |