| SpectraBase Compound ID | AHbFeZh6A5Z |
|---|---|
| InChI | InChI=1S/C31H36O11/c1-7-8-19(32)40-24-26(2,3)16(11-20(33)37-6)28(5)23(35)29(24,36)25-30(42-25)17-12-21(34)39-22(15-9-10-38-14-15)27(17,4)13-18-31(28,30)41-18/h7-10,14,16-18,22,24-25,36H,11-13H2,1-6H3/b8-7+/t16-,17+,18+,22+,24-,25+,27+,28+,29-,30+,31-/m0/s1 |
| InChIKey | PAHJBLXQLRWERN-NUOUTMFXSA-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 | IjODGwvmTWk |
|---|---|
| Name | TRICHINENLIDE_J |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H36O11 |
| InChI | InChI=1S/C31H36O11/c1-7-8-19(32)40-24-26(2,3)16(11-20(33)37-6)28(5)23(35)29(24,36)25-30(42-25)17-12-21(34)39-22(15-9-10-38-14-15)27(17,4)13-18-31(28,30)41-18/h7-10,14,16-18,22,24-25,36H,11-13H2,1-6H3/b8-7+/t16-,17+,18+,22+,24-,25+,27+,28+,29-,30+,31-/m0/s1 |
| InChIKey | PAHJBLXQLRWERN-NUOUTMFXSA-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 | UWMZ43309 |