| SpectraBase Compound ID | DfDOCi1l920 |
|---|---|
| InChI | InChI=1S/C27H42O5/c1-16-7-12-25(31-15-16)17(2)27(30)24(4)11-9-21-20(22(24)14-26(27,29)32-25)6-5-18-13-19(28)8-10-23(18,21)3/h5,16-17,19-22,28-30H,6-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23-,24-,25+,26-,27-/m0/s1 |
| InChIKey | RRWWOGBAGLECDQ-YSKYOHBCSA-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 | KQBlevVxqwj |
|---|---|
| Name | DENFIGENIN;(25R)-3-BETA,16-ALPHA,17-ALPHA-TRIHYDROXY-SPIROSTAN-5-ENE |
| Compound Number | 67 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O5 |
| InChI | InChI=1S/C27H42O5/c1-16-7-12-25(31-15-16)17(2)27(30)24(4)11-9-21-20(22(24)14-26(27,29)32-25)6-5-18-13-19(28)8-10-23(18,21)3/h5,16-17,19-22,28-30H,6-15H2,1-4H3/t16-,17+,19-,20+,21-,22-,23-,24-,25+,26-,27-/m0/s1 |
| InChIKey | RRWWOGBAGLECDQ-YSKYOHBCSA-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 | C5D5N |
| Source File Reference | UWCS22155 |