| SpectraBase Compound ID | 90pnzhH97fM |
|---|---|
| InChI | InChI=1S/C31H42N4O4/c1-7-21(4)26-30(37)32-18-17-22-13-15-24(16-14-22)39-28(20(2)3)27(31(38)33-26)34-29(36)25(35(5)6)19-23-11-9-8-10-12-23/h8-18,20-21,25-28H,7,19H2,1-6H3,(H,32,37)(H,33,38)(H,34,36)/b18-17- |
| InChIKey | NFJKQANKUCVGAW-ZCXUNETKSA-N |
| Mol Weight | 534.7 g/mol |
| Molecular Formula | C31H42N4O4 |
| Exact Mass | 534.320606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3CldfimNqUu |
|---|---|
| Name | ADOUTINE-Y' |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42N4O4 |
| InChI | InChI=1S/C31H42N4O4/c1-7-21(4)26-30(37)32-18-17-22-13-15-24(16-14-22)39-28(20(2)3)27(31(38)33-26)34-29(36)25(35(5)6)19-23-11-9-8-10-12-23/h8-18,20-21,25-28H,7,19H2,1-6H3,(H,32,37)(H,33,38)(H,34,36)/b18-17- |
| InChIKey | NFJKQANKUCVGAW-ZCXUNETKSA-N |
| Literature Reference Author | E.C.MACHADO,A.A.FILHO,A.F.MOREL,F.D.MONACHE |
| Literature Reference Citation | J.NAT.PROD.,58,548(1995) |
| Literature Reference DOI | 10.1021/np50118a010 |
| Molecular Weight | 534.699 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSK80 |