| SpectraBase Compound ID | CULlbKu44IY |
|---|---|
| InChI | InChI=1S/C28H37NO4/c1-19-11-15-28(3)23(26(32)33)5-4-6-24(28)27(19,2)16-12-21-14-18-29(25(21)31)17-13-20-7-9-22(30)10-8-20/h5,7-10,14,19,24,30H,4,6,11-13,15-18H2,1-3H3,(H,32,33)/t19-,24-,27+,28+/m1/s1 |
| InChIKey | FJBITCQPFVHFSN-MLXWKZDWSA-N |
| Mol Weight | 451.6 g/mol |
| Molecular Formula | C28H37NO4 |
| Exact Mass | 451.272259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9EWU12GYus3 |
|---|---|
| Name | ECHINOPHYLLIN_A |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H37NO4 |
| InChI | InChI=1S/C28H37NO4/c1-19-11-15-28(3)23(26(32)33)5-4-6-24(28)27(19,2)16-12-21-14-18-29(25(21)31)17-13-20-7-9-22(30)10-8-20/h5,7-10,14,19,24,30H,4,6,11-13,15-18H2,1-3H3,(H,32,33)/t19-,24-,27+,28+/m1/s1 |
| InChIKey | FJBITCQPFVHFSN-MLXWKZDWSA-N |
| Literature Reference Author | W.WANG,Z.ALI,X.C.LI,T.A.SMILLIE,D.A.GUO,I.A.KHAN |
| Literature Reference Citation | FITOTERAPIA,80,404(2009) |
| Literature Reference DOI | 10.1016/j.fitote.2009.05.013 |
| Molecular Weight | 451.606 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMB309 |