| SpectraBase Compound ID | J37Vl8Gy1iC |
|---|---|
| InChI | InChI=1S/C31H36O10/c1-7-8-20(32)40-25-27(2,3)18(13-21(33)37-6)29(5)17-9-11-28(4)19(31(17)26(41-31)30(25,36)24(29)35)14-22(34)39-23(28)16-10-12-38-15-16/h7-10,12,15,18-19,23,25-26,36H,11,13-14H2,1-6H3/b8-7+/t18-,19+,23+,25-,26+,28+,29+,30-,31+/m0/s1 |
| InChIKey | SGMKQRGSUCSUNU-TWNUFBPVSA-N |
| Mol Weight | 568.6 g/mol |
| Molecular Formula | C31H36O10 |
| Exact Mass | 568.230847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6U1bJwM1PIJ |
|---|---|
| Name | TRICHINENLIDE_B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H36O10 |
| InChI | InChI=1S/C31H36O10/c1-7-8-20(32)40-25-27(2,3)18(13-21(33)37-6)29(5)17-9-11-28(4)19(31(17)26(41-31)30(25,36)24(29)35)14-22(34)39-23(28)16-10-12-38-15-16/h7-10,12,15,18-19,23,25-26,36H,11,13-14H2,1-6H3/b8-7+/t18-,19+,23+,25-,26+,28+,29+,30-,31+/m0/s1 |
| InChIKey | SGMKQRGSUCSUNU-TWNUFBPVSA-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 | 568.621 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ43301 |