| SpectraBase Compound ID | 1fHcsssDOuR |
|---|---|
| InChI | InChI=1S/C21H32O5/c1-11(22)13-4-5-14-12-8-18(25)21(26)10-17(24)16(23)9-20(21,3)15(12)6-7-19(13,14)2/h12-17,23-24,26H,4-10H2,1-3H3/t12-,13+,14-,15-,16+,17-,19+,20+,21-/m0/s1 |
| InChIKey | ISDSVCXTDXOPPO-DPFBFGBRSA-N |
| Mol Weight | 364.5 g/mol |
| Molecular Formula | C21H32O5 |
| Exact Mass | 364.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CkfYFpgH2UG |
|---|---|
| Name | 2-ALPHA,3-ALPHA,5-TRIHYDROXY-5-ALPHA-PREGNANE-6,20-DIONE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O5 |
| InChI | InChI=1S/C21H32O5/c1-11(22)13-4-5-14-12-8-18(25)21(26)10-17(24)16(23)9-20(21,3)15(12)6-7-19(13,14)2/h12-17,23-24,26H,4-10H2,1-3H3/t12-,13+,14-,15-,16+,17-,19+,20+,21-/m0/s1 |
| InChIKey | ISDSVCXTDXOPPO-DPFBFGBRSA-N |
| Literature Reference Author | D.G.RIVERA,F.COLL |
| Literature Reference Citation | CAN.J.CHEM.,83,1084(2005) |
| Literature Reference DOI | 10.1139/v05-051 |
| Molecular Weight | 364.482 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU30244 |