| SpectraBase Compound ID | GaYS86hyaxk |
|---|---|
| InChI | InChI=1S/C39H42N2O19/c1-10-4-16-23(30(49)20(10)36(53)41-17(8-42)37(54)55)22-14(7-15-24(31(22)50)27(46)13-5-12(56-3)6-18(43)21(13)26(15)45)28(47)34(16)59-39-33(52)35(25(40)11(2)58-39)60-38-32(51)29(48)19(44)9-57-38/h4-7,11,17,19,25,28-29,32-35,38-39,42-44,47-52H,8-9,40H2,1-3H3,(H,41,53)(H,54,55)/t11-,17+,19+,25+,28-,29-,32+,33-,34-,35+,38-,39+/m0/s1 |
| InChIKey | JNJSOWKXFVKKCL-DQDRRXISSA-N |
| Mol Weight | 842.8 g/mol |
| Molecular Formula | C39H42N2O19 |
| Exact Mass | 842.238177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4wtKONDsZ5f |
|---|---|
| Name | PRADIMICIN-FA-2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H42N2O19 |
| InChI | InChI=1S/C39H42N2O19/c1-10-4-16-23(30(49)20(10)36(53)41-17(8-42)37(54)55)22-14(7-15-24(31(22)50)27(46)13-5-12(56-3)6-18(43)21(13)26(15)45)28(47)34(16)59-39-33(52)35(25(40)11(2)58-39)60-38-32(51)29(48)19(44)9-57-38/h4-7,11,17,19,25,28-29,32-35,38-39,42-44,47-52H,8-9,40H2,1-3H3,(H,41,53)(H,54,55)/t11-,17+,19+,25+,28-,29-,32+,33-,34-,35+,38-,39+/m0/s1 |
| InChIKey | JNJSOWKXFVKKCL-DQDRRXISSA-N |
| Literature Reference Author | Y.SAWADA,M.HATORI,H.YAMAMOTO,M.NISHIO,T.MIYAKI,T.OKI |
| Literature Reference Citation | J.ANTIBIOTICS,43,1223(1990) |
| Literature Reference DOI | 10.7164/antibiotics.43.1223 |
| Molecular Weight | 842.764 g/mol |
| Sample ID | 65964 |
| Solvent | DMSO-D6 |