SpectraBase Compound ID | H4GmLAjW6mT |
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InChI | InChI=1S/C25H40O6/c1-4-5-10-13-20-15-16-21(29-28-20)14-11-8-6-7-9-12-17-24(2)19-25(3)22(30-31-24)18-23(26)27-25/h10,13,15-16,20-22H,4-9,11-12,14,17-19H2,1-3H3/b13-10+/t20?,21?,22-,24-,25-/m0/s1 |
InChIKey | ZUVDVYNHEAFLQJ-FEXYSJRNSA-N |
Mol Weight | 436.6 g/mol |
Molecular Formula | C25H40O6 |
Exact Mass | 436.282489 g/mol |
SpectraBase Spectrum ID | DLbzNGBkOLY |
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Name | PLAKORTOPEROXIDE_C |
Compound Number | 7 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C25H40O6 |
InChI | InChI=1S/C25H40O6/c1-4-5-10-13-20-15-16-21(29-28-20)14-11-8-6-7-9-12-17-24(2)19-25(3)22(30-31-24)18-23(26)27-25/h10,13,15-16,20-22H,4-9,11-12,14,17-19H2,1-3H3/b13-10+/t20?,21?,22-,24-,25-/m0/s1 |
InChIKey | ZUVDVYNHEAFLQJ-FEXYSJRNSA-N |
Literature Reference Author | K.W.L.YONG,L.K.LAMBERT,P.Y.HAYES,J.J.DEVOSS,M.J.GARSON |
Literature Reference Citation | J.NAT.PROD.,75,351(2012) |
Literature Reference DOI | 10.1021/np200619q |
Molecular Weight | 436.589 g/mol |
Sample ID | 40112 |
Solvent | CDCl3 |