| SpectraBase Compound ID | LsWQLvHhGje |
|---|---|
| InChI | InChI=1S/C37H44O15/c1-10-11-22(41)51-33-34(5,6)27(26(30(42)46-9)49-18(3)39)36(8)21-12-14-35(7)24(23(21)29(50-19(4)40)37(33,45)32(36)44)25(48-17(2)38)31(43)52-28(35)20-13-15-47-16-20/h10-11,13,15-16,21,25-29,33,45H,12,14H2,1-9H3/b11-10+/t21-,25+,26?,27-,28+,29-,33-,35+,36+,37-/m0/s1 |
| InChIKey | MBGIGFVWRPHBRZ-PZRQAFHGSA-N |
| Mol Weight | 728.7 g/mol |
| Molecular Formula | C37H44O15 |
| Exact Mass | 728.268021 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MUa0bs2KTb |
|---|---|
| Name | TRICHINENLIDE_O |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H44O15 |
| InChI | InChI=1S/C37H44O15/c1-10-11-22(41)51-33-34(5,6)27(26(30(42)46-9)49-18(3)39)36(8)21-12-14-35(7)24(23(21)29(50-19(4)40)37(33,45)32(36)44)25(48-17(2)38)31(43)52-28(35)20-13-15-47-16-20/h10-11,13,15-16,21,25-29,33,45H,12,14H2,1-9H3/b11-10+/t21-,25+,26?,27-,28+,29-,33-,35+,36+,37-/m0/s1 |
| InChIKey | MBGIGFVWRPHBRZ-PZRQAFHGSA-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 | 728.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ43314 |