| SpectraBase Compound ID | PLl2ysKMlb |
|---|---|
| InChI | InChI=1S/C31H36O11/c1-7-8-18(32)41-25-27(2,3)21(20(34)23(35)38-6)29(5)16-9-11-28(4)17(31(16)26(42-31)30(25,37)24(29)36)13-19(33)40-22(28)15-10-12-39-14-15/h7-10,12,14,17,20-22,25-26,34,37H,11,13H2,1-6H3/b8-7+/t17-,20?,21+,22-,25+,26-,28-,29-,30+,31-/m1/s1 |
| InChIKey | UCHPUEMCYMPXDX-HPXLBNHPSA-N |
| Mol Weight | 584.6 g/mol |
| Molecular Formula | C31H36O11 |
| Exact Mass | 584.225762 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ARqRrpEiPqy |
|---|---|
| Name | TRICHINENLIDE_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H36O11 |
| InChI | InChI=1S/C31H36O11/c1-7-8-18(32)41-25-27(2,3)21(20(34)23(35)38-6)29(5)16-9-11-28(4)17(31(16)26(42-31)30(25,37)24(29)36)13-19(33)40-22(28)15-10-12-39-14-15/h7-10,12,14,17,20-22,25-26,34,37H,11,13H2,1-6H3/b8-7+/t17-,20?,21+,22-,25+,26-,28-,29-,30+,31-/m1/s1 |
| InChIKey | UCHPUEMCYMPXDX-HPXLBNHPSA-N |
| Literature Reference Author | J.B.XU,Y.LIN,S.H.DONG,F.WANG,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,76,1872(2013) |
| Literature Reference DOI | 10.1021/np400408s |
| Molecular Weight | 584.620 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ43302 |