| SpectraBase Compound ID | DMhzVr00xd |
|---|---|
| InChI | InChI=1S/C32H38O12/c1-8-14(2)22(35)42-25-27(3,4)20(19(34)23(36)39-7)29(6)24(37)30(25,38)26-31(44-26)16-11-18(33)41-21(15-9-10-40-13-15)28(16,5)12-17-32(29,31)43-17/h8-10,13,16-17,19-21,25-26,34,38H,11-12H2,1-7H3/b14-8+/t16-,17-,19?,20+,21+,25+,26-,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | NZSLBIWCBYLTCO-KEMAXSDFSA-N |
| Mol Weight | 614.6 g/mol |
| Molecular Formula | C32H38O12 |
| Exact Mass | 614.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CD5MhQORlfL |
|---|---|
| Name | TRICHINENLIDE_K |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H38O12 |
| InChI | InChI=1S/C32H38O12/c1-8-14(2)22(35)42-25-27(3,4)20(19(34)23(36)39-7)29(6)24(37)30(25,38)26-31(44-26)16-11-18(33)41-21(15-9-10-40-13-15)28(16,5)12-17-32(29,31)43-17/h8-10,13,16-17,19-21,25-26,34,38H,11-12H2,1-7H3/b14-8+/t16-,17-,19?,20+,21+,25+,26-,28-,29-,30+,31-,32+/m1/s1 |
| InChIKey | NZSLBIWCBYLTCO-KEMAXSDFSA-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 | 614.647 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ43310 |