| SpectraBase Compound ID | DYwKqYqOqsg |
|---|---|
| InChI | InChI=1S/C31H42O7/c1-8-19(2)28(34)36-24-16-20(3)31-18-23(29(5,6)38-31)17-25(30(31,7)27(24)35-21(4)32)37-26(33)15-14-22-12-10-9-11-13-22/h9-15,19-20,23-25,27H,8,16-18H2,1-7H3/b15-14+/t19?,20-,23-,24+,25+,27+,30-,31+/m1/s1 |
| InChIKey | NVFCLOIFOWKEPZ-MMMRIRHKSA-N |
| Mol Weight | 526.7 g/mol |
| Molecular Formula | C31H42O7 |
| Exact Mass | 526.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5pcMECNVLyj |
|---|---|
| Name | TRIPTOGELIN-E-3 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42O7 |
| InChI | InChI=1S/C31H42O7/c1-8-19(2)28(34)36-24-16-20(3)31-18-23(29(5,6)38-31)17-25(30(31,7)27(24)35-21(4)32)37-26(33)15-14-22-12-10-9-11-13-22/h9-15,19-20,23-25,27H,8,16-18H2,1-7H3/b15-14+/t19?,20-,23-,24+,25+,27+,30-,31+/m1/s1 |
| InChIKey | NVFCLOIFOWKEPZ-MMMRIRHKSA-N |
| Literature Reference Author | Y.TAKAISHI,S.TAMAI,K.NAKANO,K.MURAKAMI,T.TOMIMATSU |
| Literature Reference Citation | PHYTOCHEM.,30,3027(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)98245-1 |
| Molecular Weight | 526.670 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN30989 |