| SpectraBase Compound ID | Dd6Jrk6l3GI |
|---|---|
| InChI | InChI=1S/C40H56O17/c1-19(2)35(48)54-34-29(50-22(6)41)33(52-24(8)43)37(11,12)16-14-21(5)30(47)40(56-26(10)45)18-38(13,55-25(9)44)31(51-23(7)42)28(40)32-39(34,17-15-27(46)53-32)57-36(49)20(3)4/h14,16,19-21,28-29,31-34H,15,17-18H2,1-13H3/b16-14+/t21-,28+,29-,31+,32+,33+,34-,38+,39-,40+/m0/s1 |
| InChIKey | ZSJFAQDKIXULKO-MXBBKPOHSA-N |
| Mol Weight | 808.9 g/mol |
| Molecular Formula | C40H56O17 |
| Exact Mass | 808.35175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2AOWiSfEo1 |
|---|---|
| Name | TERRACINOLIDE-F |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H56O17 |
| InChI | InChI=1S/C40H56O17/c1-19(2)35(48)54-34-29(50-22(6)41)33(52-24(8)43)37(11,12)16-14-21(5)30(47)40(56-26(10)45)18-38(13,55-25(9)44)31(51-23(7)42)28(40)32-39(34,17-15-27(46)53-32)57-36(49)20(3)4/h14,16,19-21,28-29,31-34H,15,17-18H2,1-13H3/b16-14+/t21-,28+,29-,31+,32+,33+,34-,38+,39-,40+/m0/s1 |
| InChIKey | ZSJFAQDKIXULKO-MXBBKPOHSA-N |
| Literature Reference Author | J.A.MARCO,J.F.SANZ-CERVERA,A.YUSTE,J.JAKUPOVIC |
| Literature Reference Citation | PHYTOCHEM.,45,137(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00797-2 |
| Molecular Weight | 808.874 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP1237 |