| SpectraBase Compound ID | 3K8vZnwYIcB |
|---|---|
| InChI | InChI=1S/C36H56N4O9/c1-12-13-26-23(8)35(45)48-31(22(6)7)34(44)40(10)29(20(2)3)36(46)49-30(21(4)5)33(43)39(9)27(32(42)37-19-28(41)38-26)18-24-14-16-25(47-11)17-15-24/h14-17,20-23,26-27,29-31H,12-13,18-19H2,1-11H3,(H,37,42)(H,38,41)/t23?,26?,27-,29+,30+,31+/m1/s1 |
| InChIKey | UFZHQKNOTHZBQG-WRCAOINYSA-N |
| Mol Weight | 688.9 g/mol |
| Molecular Formula | C36H56N4O9 |
| Exact Mass | 688.404729 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LK0w7IiVbzo |
|---|---|
| Name | GUINEAMIDE-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H56N4O9 |
| InChI | InChI=1S/C36H56N4O9/c1-12-13-26-23(8)35(45)48-31(22(6)7)34(44)40(10)29(20(2)3)36(46)49-30(21(4)5)33(43)39(9)27(32(42)37-19-28(41)38-26)18-24-14-16-25(47-11)17-15-24/h14-17,20-23,26-27,29-31H,12-13,18-19H2,1-11H3,(H,37,42)(H,38,41)/t23?,26?,27-,29+,30+,31+/m1/s1 |
| InChIKey | UFZHQKNOTHZBQG-WRCAOINYSA-N |
| Literature Reference Author | L.T.TAN,N.SITACHITTA,W.H.GERWICK |
| Literature Reference Citation | J.NAT.PROD.,66,764(2003) |
| Literature Reference DOI | 10.1021/np020492o |
| Molecular Weight | 688.862 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI7841 |