SpectraBase Compound ID | GjVjAx2rIpg |
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InChI | InChI=1S/C39H42N2O7/c1-28(42)40-33-22-12-21-32(24-33)38(43)41-35-34(27-45-23-13-20-29-14-6-3-7-15-29)48-39(44-2)37(47-26-31-18-10-5-11-19-31)36(35)46-25-30-16-8-4-9-17-30/h3-22,24,34-37,39H,23,25-27H2,1-2H3,(H,40,42)(H,41,43)/b20-13+/t34-,35+,36+,37-,39+/m0/s1 |
InChIKey | JDJJTRXDLATSJO-ZECDSMTHSA-N |
Mol Weight | 650.8 g/mol |
Molecular Formula | C39H42N2O7 |
Exact Mass | 650.299202 g/mol |
SpectraBase Spectrum ID | 6vn38WJT6Lh |
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Name | JDJJTRXDLATSJO-ZECDSMTHSA-N |
Compound Number | 38 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C39H42N2O7 |
InChI | InChI=1S/C39H42N2O7/c1-28(42)40-33-22-12-21-32(24-33)38(43)41-35-34(27-45-23-13-20-29-14-6-3-7-15-29)48-39(44-2)37(47-26-31-18-10-5-11-19-31)36(35)46-25-30-16-8-4-9-17-30/h3-22,24,34-37,39H,23,25-27H2,1-2H3,(H,40,42)(H,41,43)/b20-13+/t34-,35+,36+,37-,39+/m0/s1 |
InChIKey | JDJJTRXDLATSJO-ZECDSMTHSA-N |
Literature Reference Author | D.H.S.LEAL,C.G.QUEIROGA,M.C.PIRES,M.A.F.PRADO,R.J.ALVES,A.CE SAR |
Literature Reference Citation | QUIM.NOVA,32,2387(2009) |
Molecular Weight | 650.772 g/mol |
Solvent | CDCl3 |
Source File Reference | UWBT12038 |