| SpectraBase Compound ID | 52sR0IwJqKp |
|---|---|
| InChI | InChI=1S/C38H49N3O8S/c1-23-14-13-18-28-35(45)29(21-30-36(28)50-22-33(43)41-30)40-32(42)20-27(48-4)17-11-6-5-7-12-19-31(24(2)34(23)44)49-38(47)25(3)39-37(46)26-15-9-8-10-16-26/h5-7,11-12,14-15,17,21,24-25,27,31,34,44-45H,8-10,13,16,18-20,22H2,1-4H3,(H,39,46)(H,40,42)(H,41,43)/b6-5+,12-7+,17-11+,23-14- |
| InChIKey | NVTIRGZIENXFCP-MHVOAVBDSA-N |
| Mol Weight | 707.9 g/mol |
| Molecular Formula | C38H49N3O8S |
| Exact Mass | 707.324037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JeAz8ukoweP |
|---|---|
| Name | THIAZINOTRIENOMYCIN-D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H49N3O8S |
| InChI | InChI=1S/C38H49N3O8S/c1-23-14-13-18-28-35(45)29(21-30-36(28)50-22-33(43)41-30)40-32(42)20-27(48-4)17-11-6-5-7-12-19-31(24(2)34(23)44)49-38(47)25(3)39-37(46)26-15-9-8-10-16-26/h5-7,11-12,14-15,17,21,24-25,27,31,34,44-45H,8-10,13,16,18-20,22H2,1-4H3,(H,39,46)(H,40,42)(H,41,43)/b6-5+,12-7+,17-11+,23-14- |
| InChIKey | NVTIRGZIENXFCP-MHVOAVBDSA-N |
| Literature Reference Author | N.HOSOKAWA,H.NAGANAWA,H.IINUMA,M.HAMADA,T.TAKEUCHI,T.KANBE,M .HORI |
| Literature Reference Citation | J.ANTIBIOTICS,48,471(1995) |
| Literature Reference DOI | 10.7164/antibiotics.48.471 |
| Molecular Weight | 707.882 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBS241 |