| SpectraBase Compound ID | 4Rp1YN4kW8W |
|---|---|
| InChI | InChI=1S/C27H42O5/c1-14-7-10-27(31-13-14)15(2)21-20(32-27)12-19-18-6-5-16-11-17(28)8-9-25(16,3)22(18)23(29)24(30)26(19,21)4/h14-22,24,28,30H,5-13H2,1-4H3/t14-,15-,16-,17-,18-,19-,20-,21-,22+,24+,25-,26-,27+/m0/s1 |
| InChIKey | DGRJLOFFNWNGJO-CQEHQMDISA-N |
| Mol Weight | 446.6 g/mol |
| Molecular Formula | C27H42O5 |
| Exact Mass | 446.303224 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7RZ6tUPizjE |
|---|---|
| Name | (25R)-3-BETA,12-BETA-DIHYDROXY-5-ALPHA-SPIROSTAN-11-ONE |
| Compound Number | 33 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O5 |
| InChI | InChI=1S/C27H42O5/c1-14-7-10-27(31-13-14)15(2)21-20(32-27)12-19-18-6-5-16-11-17(28)8-9-25(16,3)22(18)23(29)24(30)26(19,21)4/h14-22,24,28,30H,5-13H2,1-4H3/t14-,15-,16-,17-,18-,19-,20-,21-,22+,24+,25-,26-,27+/m0/s1 |
| InChIKey | DGRJLOFFNWNGJO-CQEHQMDISA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK |
| Literature Reference Citation | MAGN.RES.CHEM.,33,923(1995) |
| Literature Reference DOI | 10.1002/mrc.1260331202 |
| Molecular Weight | 446.627 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22121 |