SpectraBase Compound ID | 16qcRIojxop |
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InChI | InChI=1S/C32H42O12/c1-17(2)27(36)43-26-23(40-19(4)34)15-30(8,38)32-25(41-20(5)35)22(29(6,7)44-32)14-24(31(26,32)16-39-18(3)33)42-28(37)21-12-10-9-11-13-21/h9-13,17,22-26,38H,14-16H2,1-8H3/t22-,23+,24+,25-,26+,30+,31-,32+/m1/s1 |
InChIKey | YVIPLCOAOKLXGX-SKFBFMKNSA-N |
Mol Weight | 618.7 g/mol |
Molecular Formula | C32H42O12 |
Exact Mass | 618.267627 g/mol |
SpectraBase Spectrum ID | 7ot7Q13ZaFZ |
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Name | 1-BETA-ISOBUTYRYLOXY-2-BETA,6-ALPHA,15-TRIACETOXY-9-ALPHA-BENZOYLOXY-4-ALPHA-HYDROXY-DIHYDRO-BETA-AGAROFURAN |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C32H42O12 |
InChI | InChI=1S/C32H42O12/c1-17(2)27(36)43-26-23(40-19(4)34)15-30(8,38)32-25(41-20(5)35)22(29(6,7)44-32)14-24(31(26,32)16-39-18(3)33)42-28(37)21-12-10-9-11-13-21/h9-13,17,22-26,38H,14-16H2,1-8H3/t22-,23+,24+,25-,26+,30+,31-,32+/m1/s1 |
InChIKey | YVIPLCOAOKLXGX-SKFBFMKNSA-N |
Literature Reference Author | J.HOHMANN,Z.DINI,I.PELCZER,G.JERKOVICH |
Literature Reference Citation | PHYTOCHEM.,35,1267(1994) |
Literature Reference DOI | 10.1016/S0031-9422(00)94834-9 |
Molecular Weight | 618.678 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMS24503 |