SpectraBase Compound ID | 855ey5wmBc3 |
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InChI | InChI=1S/C32H38O8/c1-6-17(2)28(36)39-15-21-13-22-24-23(30(24,5)16-40-29(37)20-10-8-7-9-11-20)12-19(4)31(27(22)35)14-18(3)25(33)32(31,38)26(21)34/h6-11,13-14,19,22-26,33-34,38H,12,15-16H2,1-5H3/b17-6-/t19-,22+,23-,24+,25+,26-,30-,31+,32-/m1/s1 |
InChIKey | OTHCHCNQKHHGNQ-PHEQUDGUSA-N |
Mol Weight | 550.6 g/mol |
Molecular Formula | C32H38O8 |
Exact Mass | 550.256668 g/mol |
SpectraBase Spectrum ID | AcCz49lMQPt |
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Name | 17-HYDROXYINGENOL-17-BENZOATE-20-ANGELATE |
Compound Number | 8 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C32H38O8 |
InChI | InChI=1S/C32H38O8/c1-6-17(2)28(36)39-15-21-13-22-24-23(30(24,5)16-40-29(37)20-10-8-7-9-11-20)12-19(4)31(27(22)35)14-18(3)25(33)32(31,38)26(21)34/h6-11,13-14,19,22-26,33-34,38H,12,15-16H2,1-5H3/b17-6-/t19-,22+,23-,24+,25+,26-,30-,31+,32-/m1/s1 |
InChIKey | OTHCHCNQKHHGNQ-PHEQUDGUSA-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 | 550.649 g/mol |
Solvent | CDCl3 |
Source File Reference | UWSP1455 |