SpectraBase Compound ID | 8xMA4YtllPm |
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InChI | InChI=1S/C28H37ClO12/c1-13-25(34)41-22-10-18(12-29)8-9-19(37-14(2)30)26(6)20(38-15(3)31)11-21(39-16(4)32)27(7,35)23(26)24(28(13,22)36)40-17(5)33/h8-10,13,19-24,35-36H,11-12H2,1-7H3/b9-8-,18-10+/t13-,19-,20-,21+,22-,23+,24-,26-,27+,28-/m0/s1 |
InChIKey | BGDGJYXQTNDSRM-ZTKDCQGGSA-N |
Mol Weight | 601.0 g/mol |
Molecular Formula | C28H37ClO12 |
Exact Mass | 600.197354 g/mol |
SpectraBase Spectrum ID | BOaIhzZmbut |
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Name | BRIAREIN-J |
Compound Number | 10 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C28H37ClO12 |
InChI | InChI=1S/C28H37ClO12/c1-13-25(34)41-22-10-18(12-29)8-9-19(37-14(2)30)26(6)20(38-15(3)31)11-21(39-16(4)32)27(7,35)23(26)24(28(13,22)36)40-17(5)33/h8-10,13,19-24,35-36H,11-12H2,1-7H3/b9-8-,18-10+/t13-,19-,20-,21+,22-,23+,24-,26-,27+,28-/m0/s1 |
InChIKey | BGDGJYXQTNDSRM-ZTKDCQGGSA-N |
Literature Reference Author | A.D.RODRIGUEZ,C.RAMIREZ,O.M.COBAR |
Literature Reference Citation | J.NAT.PROD.,59,15(1996) |
Literature Reference DOI | 10.1021/np960001y |
Molecular Weight | 601.048 g/mol |
Solvent | CDCl3 |
Source File Reference | UWVP876 |