| SpectraBase Compound ID | KHaNTOwdfdf |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-15-5-10-27(31-14-15)16(2)23-22(32-27)11-19-17-6-9-26(30)13-21(29)20(28)12-25(26,4)18(17)7-8-24(19,23)3/h15-23,28-30H,5-14H2,1-4H3/t15-,16-,17+,18-,19-,20+,21-,22-,23-,24-,25+,26+,27+/m0/s1 |
| InChIKey | IWRHKMTUIIDCDO-KOLIPCJGSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C27H44O5 |
| Exact Mass | 448.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9gGkluf73Ot |
|---|---|
| Name | (25R)-2-ALPHA,3-ALPHA,5-ALPHA-TRIHYDROXY-SPIROSTANE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O5 |
| InChI | InChI=1S/C27H44O5/c1-15-5-10-27(31-14-15)16(2)23-22(32-27)11-19-17-6-9-26(30)13-21(29)20(28)12-25(26,4)18(17)7-8-24(19,23)3/h15-23,28-30H,5-14H2,1-4H3/t15-,16-,17+,18-,19-,20+,21-,22-,23-,24-,25+,26+,27+/m0/s1 |
| InChIKey | IWRHKMTUIIDCDO-KOLIPCJGSA-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 | 448.643 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22109 |