| SpectraBase Compound ID | 6kxSFqWht02 |
|---|---|
| InChI | InChI=1S/C37H49N3O7S/c1-23-14-13-18-28-34(43)29(21-30-35(28)48-22-38-30)40-32(41)20-27(46-4)17-11-6-5-7-12-19-31(24(2)33(23)42)47-37(45)25(3)39-36(44)26-15-9-8-10-16-26/h5-7,11-12,14,17,21-22,24-27,31,33,42-43H,8-10,13,15-16,18-20H2,1-4H3,(H,39,44)(H,40,41)/b6-5+,12-7+,17-11+,23-14- |
| InChIKey | XWXHOGFLJKTTBA-MHVOAVBDSA-N |
| Mol Weight | 679.9 g/mol |
| Molecular Formula | C37H49N3O7S |
| Exact Mass | 679.329122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9yULL1fihJL |
|---|---|
| Name | THIAZINOTRIENOMYCIN-G |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H49N3O7S |
| InChI | InChI=1S/C37H49N3O7S/c1-23-14-13-18-28-34(43)29(21-30-35(28)48-22-38-30)40-32(41)20-27(46-4)17-11-6-5-7-12-19-31(24(2)33(23)42)47-37(45)25(3)39-36(44)26-15-9-8-10-16-26/h5-7,11-12,14,17,21-22,24-27,31,33,42-43H,8-10,13,15-16,18-20H2,1-4H3,(H,39,44)(H,40,41)/b6-5+,12-7+,17-11+,23-14- |
| InChIKey | XWXHOGFLJKTTBA-MHVOAVBDSA-N |
| Literature Reference Author | N.HOSOKAWA,H.NAGANAWA,M.HAMADA,H.IINUMA,T.TAKEUCHI,K.S.TSUCH IYA,M.HORI |
| Literature Reference Citation | J.ANTIBIOTICS,53,886(2000) |
| Literature Reference DOI | 10.7164/antibiotics.53.886 |
| Molecular Weight | 679.872 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWRU7248 |