| SpectraBase Compound ID | 1seUI9ftVne |
|---|---|
| InChI | InChI=1S/C44H57N7O12/c1-8-24(5)37(55)50-35(23(3)4)42(60)48-32(21-28-15-17-29(52)18-16-28)41(59)51-36-26(7)63-44(62)33(22-27-13-11-10-12-14-27)49-40(58)31(19-20-34(53)54)47-39(57)30(9-2)46-38(56)25(6)45-43(36)61/h8-18,23,25-26,31-33,35-36,52H,19-22H2,1-7H3,(H,45,61)(H,46,56)(H,47,57)(H,48,60)(H,49,58)(H,50,55)(H,51,59)(H,53,54)/b24-8+,30-9-/t25-,26+,31+,32-,33-,35-,36-/m1/s1 |
| InChIKey | HTQZRXGEFURKNL-VHVAPZFJSA-N |
| Mol Weight | 876.0 g/mol |
| Molecular Formula | C44H57N7O12 |
| Exact Mass | 875.40652 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FuyLnJ258M8 |
|---|---|
| Name | TIGLICAMIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H57N7O12 |
| InChI | InChI=1S/C44H57N7O12/c1-8-24(5)37(55)50-35(23(3)4)42(60)48-32(21-28-15-17-29(52)18-16-28)41(59)51-36-26(7)63-44(62)33(22-27-13-11-10-12-14-27)49-40(58)31(19-20-34(53)54)47-39(57)30(9-2)46-38(56)25(6)45-43(36)61/h8-18,23,25-26,31-33,35-36,52H,19-22H2,1-7H3,(H,45,61)(H,46,56)(H,47,57)(H,48,60)(H,49,58)(H,50,55)(H,51,59)(H,53,54)/b24-8+,30-9-/t25-,26+,31+,32-,33-,35-,36-/m1/s1 |
| InChIKey | HTQZRXGEFURKNL-VHVAPZFJSA-N |
| Literature Reference Author | S.MATTHEW,V.J.PAUL,H.LUESCH |
| Literature Reference Citation | PHYTOCHEM.,70,2058(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.09.010 |
| Molecular Weight | 875.976 g/mol |
| Sample ID | 64735 |
| Solvent | DMF-D7 |