| SpectraBase Compound ID | J7EeTUmHsSm |
|---|---|
| InChI | InChI=1S/C27H40O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h13,16-17,20-24H,5-12,14-15H2,1-4H3/t16-,17+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1 |
| InChIKey | AZXZUBZBLNFUPF-CLGLNXEMSA-N |
| Mol Weight | 412.6 g/mol |
| Molecular Formula | C27H40O3 |
| Exact Mass | 412.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7vXjGcXm95z |
|---|---|
| Name | DIOSGENONE;(25R)-4-SPIROSTEN-3-ONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O3 |
| InChI | InChI=1S/C27H40O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h13,16-17,20-24H,5-12,14-15H2,1-4H3/t16-,17+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1 |
| InChIKey | AZXZUBZBLNFUPF-CLGLNXEMSA-N |
| Literature Reference Author | A.PABON,G.ESCOBAR,E.VARGAS,V.CRUZ,R.NOTARIO,S.BLAIR,F.ECHEVE RRI |
| Literature Reference Citation | MOLECULES,18,3356(2013) |
| Literature Reference DOI | 10.3390/molecules18033356 |
| Molecular Weight | 412.613 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT8984 |