| SpectraBase Compound ID | Gz9bEEpviHq |
|---|---|
| InChI | InChI=1S/C36H46N2O12/c1-8-20(4)27(40)33(44)47-21(5)26(38-31(42)23-15-12-16-24(28(23)41)37-18-39)32(43)49-29(19(2)3)34(45)50-30-25(48-35(46)36(30,6)7)17-22-13-10-9-11-14-22/h9-16,18-21,25-27,29-30,40-41H,8,17H2,1-7H3,(H,37,39)(H,38,42) |
| InChIKey | PYZRRZNLGZIEJJ-UHFFFAOYSA-N |
| Mol Weight | 698.8 g/mol |
| Molecular Formula | C36H46N2O12 |
| Exact Mass | 698.305075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8fy2ilX7Xv3 |
|---|---|
| Name | ISONEOANTIMYCIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H46N2O12 |
| InChI | InChI=1S/C36H46N2O12/c1-8-20(4)27(40)33(44)47-21(5)26(38-31(42)23-15-12-16-24(28(23)41)37-18-39)32(43)49-29(19(2)3)34(45)50-30-25(48-35(46)36(30,6)7)17-22-13-10-9-11-14-22/h9-16,18-21,25-27,29-30,40-41H,8,17H2,1-7H3,(H,37,39)(H,38,42) |
| InChIKey | PYZRRZNLGZIEJJ-UHFFFAOYSA-N |
| Literature Reference Author | Y.TAKEDA,T.MASUDA,T.MATSUMOTO,Y.TAKECHI,T.SHINGU,H.G.FLOSS |
| Literature Reference Citation | J.NAT.PROD.,61,978(1998) |
| Literature Reference DOI | 10.1021/np9800194 |
| Molecular Weight | 698.767 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK3414 |