SpectraBase Compound ID | 87PXD7t4crw |
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InChI | InChI=1S/C28H42O4/c1-16(23(31)15-28(6)25(2,3)32-28)19-7-8-20-24-21(10-12-27(19,20)5)26(4)11-9-18(29)13-17(26)14-22(24)30/h9,11,13,16,19-24,30-31H,7-8,10,12,14-15H2,1-6H3 |
InChIKey | RPCWUNDQUXNHLA-UHFFFAOYSA-N |
Mol Weight | 442.6 g/mol |
Molecular Formula | C28H42O4 |
Exact Mass | 442.30831 g/mol |
SpectraBase Spectrum ID | GhDF94A0IZW |
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Name | Petuniasterone C |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C28H42O4 |
InChI | InChI=1S/C28H42O4/c1-16(23(31)15-28(6)25(2,3)32-28)19-7-8-20-24-21(10-12-27(19,20)5)26(4)11-9-18(29)13-17(26)14-22(24)30/h9,11,13,16,19-24,30-31H,7-8,10,12,14-15H2,1-6H3 |
InChIKey | RPCWUNDQUXNHLA-UHFFFAOYSA-N |
Literature Reference | C.A. Elliger, M.E. Benson, W.F.Haddon, J. Chem. Soc. Perkin I 711 (1988). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |