| SpectraBase Compound ID | ESBLJeYQxbH |
|---|---|
| InChI | InChI=1S/C36H55NO9/c1-22-10-7-5-6-8-12-28(38)25(4)32-18-14-24(3)36(44,46-32)33(41)34(42)37-19-9-11-27(37)35(43)45-31(17-13-22)23(2)20-26-15-16-29(39)30(40)21-26/h7-8,10,12,22-27,29-32,39-40,44H,5-6,9,11,13-21H2,1-4H3/b10-7+,12-8+/t22-,23+,24-,25+,26-,27+,29+,30+,31+,32+,36-/m1/s1 |
| InChIKey | MEIQVKKSRNVISN-IYVFZGCVSA-N |
| Mol Weight | 645.8 g/mol |
| Molecular Formula | C36H55NO9 |
| Exact Mass | 645.387682 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DkeY1Nd6tnd |
|---|---|
| Name | ANTASCOMICIN-D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H55NO9 |
| InChI | InChI=1S/C36H55NO9/c1-22-10-7-5-6-8-12-28(38)25(4)32-18-14-24(3)36(44,46-32)33(41)34(42)37-19-9-11-27(37)35(43)45-31(17-13-22)23(2)20-26-15-16-29(39)30(40)21-26/h7-8,10,12,22-27,29-32,39-40,44H,5-6,9,11,13-21H2,1-4H3/b10-7+,12-8+/t22-,23+,24-,25+,26-,27+,29+,30+,31+,32+,36-/m1/s1 |
| InChIKey | MEIQVKKSRNVISN-IYVFZGCVSA-N |
| Literature Reference Author | T.FEHR,J.J.SANGLIER,W.SCHULER,L.GSCHWIND,M.PONELLE,W.SCHILLI NG,C.WIOLAND |
| Literature Reference Citation | J.ANTIBIOTICS,49,230(1996) |
| Literature Reference DOI | 10.7164/antibiotics.49.230 |
| Molecular Weight | 645.834 g/mol |
| Solvent | DMSO |
| Source File Reference | UWCS23582 |