| SpectraBase Compound ID | HBLLuuRfif3 |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-20(25(36-21(2)33)14-16-28(3,4)35)22-12-18-32(9)24-10-11-26-29(5,6)27(34)15-17-30(26,7)23(24)13-19-31(22,32)8/h14,16,20,22,25-26,35H,10-13,15,17-19H2,1-9H3/b16-14+/t20-,22+,25+,26?,30+,31+,32-/m0/s1 |
| InChIKey | HIOCTGSCXFLFKE-SIKNWQDKSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CYUnNNDxIc0 |
|---|---|
| Name | (20S,22S,23E)-22-O-ACETYL-25-HYDROXYLANOSTA-8,23(E)-DIEN-3-ONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-20(25(36-21(2)33)14-16-28(3,4)35)22-12-18-32(9)24-10-11-26-29(5,6)27(34)15-17-30(26,7)23(24)13-19-31(22,32)8/h14,16,20,22,25-26,35H,10-13,15,17-19H2,1-9H3/b16-14+/t20-,22+,25+,26?,30+,31+,32-/m0/s1 |
| InChIKey | HIOCTGSCXFLFKE-SIKNWQDKSA-N |
| Literature Reference Author | S.KANOKMEDHAKUL,K.KANOKMEDHAKUL,T.PRAJUABSUK,K.SOYTONG,P.KON GSAEREE,A.SUKSAMRARN |
| Literature Reference Citation | PLANTA.MED.,69,568(2003) |
| Literature Reference DOI | 10.1055/s-2003-40639 |
| Molecular Weight | 498.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP1964 |