| SpectraBase Compound ID | 21GOtiNg5YH |
|---|---|
| InChI | InChI=1S/C33H38N4O4/c1-4-22(2)28-32(39)35-20-19-23-15-17-26(18-16-23)41-30(25-13-9-6-10-14-25)29(33(40)36-28)37-31(38)27(34-3)21-24-11-7-5-8-12-24/h5-20,22,27-30,34H,4,21H2,1-3H3,(H,35,39)(H,36,40)(H,37,38)/b20-19-/t22?,27-,28-,29-,30-/m0/s1 |
| InChIKey | JDFUVCMEHULMNF-AQGXPBKHSA-N |
| Mol Weight | 554.7 g/mol |
| Molecular Formula | C33H38N4O4 |
| Exact Mass | 554.289306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KpRDN3Nfpu9 |
|---|---|
| Name | SCUTIANINEM |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H38N4O4 |
| InChI | InChI=1S/C33H38N4O4/c1-4-22(2)28-32(39)35-20-19-23-15-17-26(18-16-23)41-30(25-13-9-6-10-14-25)29(33(40)36-28)37-31(38)27(34-3)21-24-11-7-5-8-12-24/h5-20,22,27-30,34H,4,21H2,1-3H3,(H,35,39)(H,36,40)(H,37,38)/b20-19-/t22?,27-,28-,29-,30-/m0/s1 |
| InChIKey | JDFUVCMEHULMNF-AQGXPBKHSA-N |
| Literature Reference Author | A.F.MOREL,G.MALDANER,V.ILHA,F.MISSAU,U.F.SILVA,I.I.DALCOL |
| Literature Reference Citation | PHYTOCHEM.,66,2571(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.08.016 |
| Molecular Weight | 554.689 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ19743 |