| SpectraBase Compound ID | 7H0sAqwaOsY |
|---|---|
| InChI | InChI=1S/C37H55NO6/c1-11-22(2)17-25(5)35-28(8)20-27(7)34(43-30(10)39)26(6)18-23(3)33(40)24(4)19-29(9)36(41)38-32(37(42)44-35)21-31-15-13-12-14-16-31/h12-16,18-20,22,24-26,28,32-35,40H,11,17,21H2,1-10H3,(H,38,41)/b23-18+,27-20+,29-19+/t22-,24-,25+,26-,28+,32-,33-,34+,35+/m0/s1 |
| InChIKey | WIRRTALUVUQONX-YIARLRPHSA-N |
| Mol Weight | 609.8 g/mol |
| Molecular Formula | C37H55NO6 |
| Exact Mass | 609.402938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HgUwPXzTnqQ |
|---|---|
| Name | METACRIDAMIDE_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H55NO6 |
| InChI | InChI=1S/C37H55NO6/c1-11-22(2)17-25(5)35-28(8)20-27(7)34(43-30(10)39)26(6)18-23(3)33(40)24(4)19-29(9)36(41)38-32(37(42)44-35)21-31-15-13-12-14-16-31/h12-16,18-20,22,24-26,28,32-35,40H,11,17,21H2,1-10H3,(H,38,41)/b23-18+,27-20+,29-19+/t22-,24-,25+,26-,28+,32-,33-,34+,35+/m0/s1 |
| InChIKey | WIRRTALUVUQONX-YIARLRPHSA-N |
| Literature Reference Author | S.B.KRASNOFF,U.ENGLICH,P.G.MILLER,M.L.SHULER,R.P.GLAHN,B.G.G .DONZELLI,D.M.GIBSON |
| Literature Reference Citation | J.NAT.PROD.,75,175(2012) |
| Literature Reference DOI | 10.1021/np2007044 |
| Molecular Weight | 609.847 g/mol |
| Sample ID | 39800 |
| Solvent | CDCl3 |