| SpectraBase Compound ID | ENBoBN6EiLG |
|---|---|
| InChI | InChI=1S/C30H48O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-23,25H,1,9-18H2,2-8H3/t20-,21+,22-,23+,25+,27+,28-,29+,30+/m0/s1 |
| InChIKey | GRBHNQFQFHLCHO-BHMAJAPKSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C30H48O |
| Exact Mass | 424.370516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8YAkqOeZVJq |
|---|---|
| Name | LUPEN-3-ONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O |
| InChI | InChI=1S/C30H48O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-23,25H,1,9-18H2,2-8H3/t20-,21+,22-,23+,25+,27+,28-,29+,30+/m0/s1 |
| InChIKey | GRBHNQFQFHLCHO-BHMAJAPKSA-N |
| Literature Reference Author | L.M.D.C.CURSINO,C.V.NUNEZ,R.C.D.PAULA,M.F.A.D.NASCIMENTO,P.A .D.SANTOS |
| Literature Reference Citation | QUIM.NOVA,35,2165(2012) |
| Literature Reference DOI | 10.1590/s0100-40422012001100011 |
| Molecular Weight | 424.711 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR12571 |