| SpectraBase Compound ID | 8lYRGIGNCCG |
|---|---|
| InChI | InChI=1S/C40H44N2O18/c1-11-6-18-24(31(49)21(11)37(53)42-12(2)38(54)55)23-16(9-17-25(32(23)50)28(46)15-7-14(56-5)8-19(43)22(15)27(17)45)29(47)35(18)59-40-34(52)36(26(41-4)13(3)58-40)60-39-33(51)30(48)20(44)10-57-39/h6-9,12-13,20,26,29-30,33-36,39-41,43-44,47-52H,10H2,1-5H3,(H,42,53)(H,54,55)/t12-,13+,20+,26-,29+,30-,33+,34+,35+,36-,39-,40-/m1/s1 |
| InChIKey | WPICPWIIIBCXCV-BWPJUAPXSA-N |
| Mol Weight | 840.8 g/mol |
| Molecular Formula | C40H44N2O18 |
| Exact Mass | 840.258913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Pq6CbKoqYF |
|---|---|
| Name | PRADIMICIN-A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H44N2O18 |
| InChI | InChI=1S/C40H44N2O18/c1-11-6-18-24(31(49)21(11)37(53)42-12(2)38(54)55)23-16(9-17-25(32(23)50)28(46)15-7-14(56-5)8-19(43)22(15)27(17)45)29(47)35(18)59-40-34(52)36(26(41-4)13(3)58-40)60-39-33(51)30(48)20(44)10-57-39/h6-9,12-13,20,26,29-30,33-36,39-41,43-44,47-52H,10H2,1-5H3,(H,42,53)(H,54,55)/t12-,13+,20+,26-,29+,30-,33+,34+,35+,36-,39-,40-/m1/s1 |
| InChIKey | WPICPWIIIBCXCV-BWPJUAPXSA-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 | 840.792 g/mol |
| Sample ID | 65962 |
| Solvent | DMSO-D6 |