| SpectraBase Compound ID | Ail5foMgvzr |
|---|---|
| InChI | InChI=1S/C29H44O5/c1-16-8-11-29(32-15-16)17(2)26-24(34-29)13-23-21-7-6-19-12-20(33-18(3)30)9-10-27(19,4)22(21)14-25(31)28(23,26)5/h16-17,19-24,26H,6-15H2,1-5H3/t16-,17-,19-,20-,21+,22-,23-,24-,26-,27-,28+,29+/m0/s1 |
| InChIKey | CVKZWRTYHCDWTE-XXJMSXTOSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C29H44O5 |
| Exact Mass | 472.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CRCWRuNfve5 |
|---|---|
| Name | HECOGENINACETAT=(25R)-3-BETA-ACETOXY-5-ALPHA-SPIROSTAN-12-ON |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O5 |
| InChI | InChI=1S/C29H44O5/c1-16-8-11-29(32-15-16)17(2)26-24(34-29)13-23-21-7-6-19-12-20(33-18(3)30)9-10-27(19,4)22(21)14-25(31)28(23,26)5/h16-17,19-24,26H,6-15H2,1-5H3/t16-,17-,19-,20-,21+,22-,23-,24-,26-,27-,28+,29+/m0/s1 |
| InChIKey | CVKZWRTYHCDWTE-XXJMSXTOSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,R.K.GUPTA,R.S.THAKUR |
| Literature Reference Citation | PHYTOCHEM.,24,2479(1985) |
| Literature Reference DOI | 10.1016/S0031-9422(00)80653-6 |
| Molecular Weight | 472.665 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW17156 |