| SpectraBase Compound ID | 1UMely0rGND |
|---|---|
| InChI | InChI=1S/C36H58N4O11S/c1-8-9-10-11-12-13-22(2)14-15-23(3)16-18-29(41)24(4)17-19-30-26(6)34(44)39-27(7)35(45)38-21-25(5)33(43)40-28(36(46)50-30)20-31(32(37)42)51-52(47,48)49/h15-16,18,22,24-26,28,30-31H,7-14,17,19-21H2,1-6H3,(H2,37,42)(H,38,45)(H,39,44)(H,40,43)(H,47,48,49)/b18-16+,23-15+ |
| InChIKey | XLDIAUNLPWGNHO-XWZQQIMHSA-N |
| Mol Weight | 754.9 g/mol |
| Molecular Formula | C36H58N4O11S |
| Exact Mass | 754.38228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Stmpe4HpTt |
|---|---|
| Name | TOPOSTATIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H58N4O11S |
| InChI | InChI=1S/C36H58N4O11S/c1-8-9-10-11-12-13-22(2)14-15-23(3)16-18-29(41)24(4)17-19-30-26(6)34(44)39-27(7)35(45)38-21-25(5)33(43)40-28(36(46)50-30)20-31(32(37)42)51-52(47,48)49/h15-16,18,22,24-26,28,30-31H,7-14,17,19-21H2,1-6H3,(H2,37,42)(H,38,45)(H,39,44)(H,40,43)(H,47,48,49)/b18-16+,23-15+ |
| InChIKey | XLDIAUNLPWGNHO-XWZQQIMHSA-N |
| Literature Reference Author | K.SUZUKI,S.YAHARA,Y.KIDO,K.NAGAO,Y.HATANO,M.UYEDA |
| Literature Reference Citation | J.ANTIBIOTICS,51,999(1998) |
| Literature Reference DOI | 10.7164/antibiotics.51.999 |
| Molecular Weight | 754.937 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP681 |