| SpectraBase Compound ID | 9XnCLTYpPbp |
|---|---|
| InChI | InChI=1S/C36H46N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)/b6-5+,12-7+,18-11+,23-14- |
| InChIKey | QWZVQZQKLAWDBP-YFQVXFPISA-N |
| Mol Weight | 634.8 g/mol |
| Molecular Formula | C36H46N2O8 |
| Exact Mass | 634.325416 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3nhsIqdldlY |
|---|---|
| Name | 13-KETO-MYCOTRIENIN_I |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H46N2O8 |
| InChI | InChI=1S/C36H46N2O8/c1-23-14-13-17-27-20-28(39)21-30(34(27)42)38-32(40)22-29(45-4)18-11-6-5-7-12-19-31(24(2)33(23)41)46-36(44)25(3)37-35(43)26-15-9-8-10-16-26/h5-7,11-12,14,18,20-21,24-26,29,31H,8-10,13,15-17,19,22H2,1-4H3,(H,37,43)(H,38,40)/b6-5+,12-7+,18-11+,23-14- |
| InChIKey | QWZVQZQKLAWDBP-YFQVXFPISA-N |
| Literature Reference Author | T.KAWAMURA,E.TASHIRO,K.YAMAMOTO,K.SHINDO,M.IMOTO |
| Literature Reference Citation | J.ANTIBIOTICS,61,303(2008) |
| Literature Reference DOI | 10.1038/ja.2008.43 |
| Molecular Weight | 634.770 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB163 |