| SpectraBase Compound ID | 2qypPNG1R7s |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-14-7-10-27(31-13-14)15(2)21-24(32-27)23(30)22-18-6-5-16-11-17(28)8-9-25(16,3)19(18)12-20(29)26(21,22)4/h14-24,28-30H,5-13H2,1-4H3/t14-,15+,16+,17+,18-,19+,20-,21+,22-,23-,24-,25+,26-,27-/m1/s1 |
| InChIKey | KRRVFCHKYIKQTQ-UWYJHYEASA-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 | EvTiLAJuysD |
|---|---|
| Name | 5-ALPHA-SPIROSTAN-3-BETA,12-BETA,15-ALPHA-TRIOL |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O5 |
| InChI | InChI=1S/C27H44O5/c1-14-7-10-27(31-13-14)15(2)21-24(32-27)23(30)22-18-6-5-16-11-17(28)8-9-25(16,3)19(18)12-20(29)26(21,22)4/h14-24,28-30H,5-13H2,1-4H3/t14-,15+,16+,17+,18-,19+,20-,21+,22-,23-,24-,25+,26-,27-/m1/s1 |
| InChIKey | KRRVFCHKYIKQTQ-UWYJHYEASA-N |
| Literature Reference Author | B.D'ABROSCA,M.DELLAGRECA,A.FIORENTINO,P.MONACO,A.NATALE,P.OR IANO,A.ZARRELLI |
| Literature Reference Citation | PHYTOCHEM.,66,2681(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.09.011 |
| Molecular Weight | 448.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ19760 |