| SpectraBase Compound ID | 1stgQ9dxVS5 |
|---|---|
| InChI | InChI=1S/C30H56N2O8/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-24(35)31-25(21(3)4)29(38)40-30-26(32-23(34)18-6-2)28(37)27(36)22(20-33)39-30/h21-22,25-28,30,33,36-37H,5-20H2,1-4H3,(H,31,35)(H,32,34)/t22-,25?,26-,27-,28-,30-/m1/s1 |
| InChIKey | KHSLDHWSUXNVCW-CBNICUGSSA-N |
| Mol Weight | 572.8 g/mol |
| Molecular Formula | C30H56N2O8 |
| Exact Mass | 572.403667 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7y0u3LVFHJ2 |
|---|---|
| Name | MAJOR_ISOMER |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H56N2O8 |
| InChI | InChI=1S/C30H56N2O8/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-24(35)31-25(21(3)4)29(38)40-30-26(32-23(34)18-6-2)28(37)27(36)22(20-33)39-30/h21-22,25-28,30,33,36-37H,5-20H2,1-4H3,(H,31,35)(H,32,34)/t22-,25?,26-,27-,28-,30-/m1/s1 |
| InChIKey | KHSLDHWSUXNVCW-CBNICUGSSA-N |
| Literature Reference Author | D.DWIVEDI,R.JANSEN,G.MOLINARI,M.NIMTZ,B.N.JOHRI,V.WRAY |
| Literature Reference Citation | J.NAT.PROD.,71,637(2008) |
| Literature Reference DOI | 10.1021/np7007126 |
| Molecular Weight | 572.783 g/mol |
| Sample ID | 27651 |
| Solvent | CD3OD |