| SpectraBase Compound ID | 6fVHmkE7NJW |
|---|---|
| InChI | InChI=1S/C27H44O3/c1-16(2)7-6-8-17(3)20-9-10-21-19-14-23(29)22-13-18(28)11-12-26(22,4)25(19)24(30)15-27(20,21)5/h16-17,19-22,24-25,30H,6-15H2,1-5H3/t17-,19+,20-,21+,22-,24-,25-,26+,27-/m1/s1 |
| InChIKey | KOBXOVMRGBLXBG-XTALENSOSA-N |
| Mol Weight | 416.6 g/mol |
| Molecular Formula | C27H44O3 |
| Exact Mass | 416.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2fYt85ScAN1 |
|---|---|
| Name | 11-ALPHA-HYDROXY-5-ALPHA-CHOLESTANE-3,6-DIONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O3 |
| InChI | InChI=1S/C27H44O3/c1-16(2)7-6-8-17(3)20-9-10-21-19-14-23(29)22-13-18(28)11-12-26(22,4)25(19)24(30)15-27(20,21)5/h16-17,19-22,24-25,30H,6-15H2,1-5H3/t17-,19+,20-,21+,22-,24-,25-,26+,27-/m1/s1 |
| InChIKey | KOBXOVMRGBLXBG-XTALENSOSA-N |
| Literature Reference Author | O.PRAKASH,R.ROY,D.S.BHAKUNI,S.WAHIDULLA,S.Y.KAMAT |
| Literature Reference Citation | J.NAT.PROD.,52,686(1989) |
| Literature Reference DOI | 10.1021/np50064a003 |
| Molecular Weight | 416.645 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS201 |