SpectraBase Compound ID | 9r9mFpFtW7z |
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InChI | InChI=1S/C33H40O10/c1-16-14-33-29(41-21(6)36)17(2)15-32(33,43-33)28(37)18(3)26(40-20(5)35)23-24(31(23,7)8)27(25(16)39-19(4)34)42-30(38)22-12-10-9-11-13-22/h9-14,17-18,23-27,29H,15H2,1-8H3/b16-14+/t17-,18-,23+,24-,25-,26+,27+,29+,32+,33+/m1/s1 |
InChIKey | VFPUAXFWMSVDLU-PWEFYMAXSA-N |
Mol Weight | 596.7 g/mol |
Molecular Formula | C33H40O10 |
Exact Mass | 596.262147 g/mol |
SpectraBase Spectrum ID | AmBEeLypV9R |
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Name | 2-EPIINGOL-3,7,12-TRIACETATE-8-BENZOATE |
Compound Number | 11 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C33H40O10 |
InChI | InChI=1S/C33H40O10/c1-16-14-33-29(41-21(6)36)17(2)15-32(33,43-33)28(37)18(3)26(40-20(5)35)23-24(31(23,7)8)27(25(16)39-19(4)34)42-30(38)22-12-10-9-11-13-22/h9-14,17-18,23-27,29H,15H2,1-8H3/b16-14+/t17-,18-,23+,24-,25-,26+,27+,29+,32+,33+/m1/s1 |
InChIKey | VFPUAXFWMSVDLU-PWEFYMAXSA-N |
Literature Reference Author | J.A.MARCO,J.F.SANZ-CERVERA,A.YUSTE |
Literature Reference Citation | PHYTOCHEM.,45,563(1997) |
Literature Reference DOI | 10.1016/S0031-9422(97)00018-6 |
Molecular Weight | 596.675 g/mol |
Solvent | CDCl3 |
Source File Reference | UWSP1461 |