| SpectraBase Compound ID | GdLBfljaJKS |
|---|---|
| InChI | InChI=1S/C33H42O7/c1-17(2)21(6)29(36)40-28-19(4)15-32-20(5)14-24-25(23(27(32)35)13-18(3)26(34)33(28,32)38)31(24,7)16-39-30(37)22-11-9-8-10-12-22/h8-13,15,17,20-21,23-26,28,34,38H,14,16H2,1-7H3/t20-,21?,23+,24-,25+,26-,28+,31-,32+,33+/m1/s1 |
| InChIKey | FRRIZFCLGOVTAU-COYHNVODSA-N |
| Mol Weight | 550.7 g/mol |
| Molecular Formula | C33H42O7 |
| Exact Mass | 550.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3WfJmhuEkYf |
|---|---|
| Name | 17-BENZOYLOXY-3-O-(2,3-DIMETHYLBUTANOYL)-20-DEOXYINGENOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42O7 |
| InChI | InChI=1S/C33H42O7/c1-17(2)21(6)29(36)40-28-19(4)15-32-20(5)14-24-25(23(27(32)35)13-18(3)26(34)33(28,32)38)31(24,7)16-39-30(37)22-11-9-8-10-12-22/h8-13,15,17,20-21,23-26,28,34,38H,14,16H2,1-7H3/t20-,21?,23+,24-,25+,26-,28+,31-,32+,33+/m1/s1 |
| InChIKey | FRRIZFCLGOVTAU-COYHNVODSA-N |
| Literature Reference Author | Z.Q.LU,M.YANG,J.Q.ZHANG,G.T.CHEN,H.L.HUANG,S.H.GUAN,C.MA,X.L IU,D.A.GUO |
| Literature Reference Citation | PHYTOCHEM.,69,812(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.09.013 |
| Molecular Weight | 550.692 g/mol |
| Sample ID | 42731 |
| Solvent | CDCl3 |