| SpectraBase Compound ID | GIWd2h8mzbe |
|---|---|
| InChI | InChI=1S/C41H72N2O16/c1-13-28-25(19-54-40-37(53-12)36(52-11)33(47)23(5)56-40)38-41(6,59-38)15-14-26(42-49)20(2)16-24(17-30(50-9)51-10)35(21(3)27(44)18-29(45)57-28)58-39-34(48)31(43(7)8)32(46)22(4)55-39/h14-15,20-25,27-28,30-40,44,46-49H,13,16-19H2,1-12H3/b15-14-,42-26+/t20?,21?,22-,23+,24?,25?,27?,28?,31+,32-,33+,34-,35?,36+,37+,38?,39+,40+,41?/m0/s1 |
| InChIKey | DBZFIXIAMFCYMU-WFFOLKLASA-N |
| Mol Weight | 849.0 g/mol |
| Molecular Formula | C41H72N2O16 |
| Exact Mass | 848.488184 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5OBHKmGPqMy |
|---|---|
| Name | 12,13-EPOXY-DESMYCOSIN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H71N2O16 |
| InChI | InChI=1S/C41H72N2O16/c1-13-28-25(19-54-40-37(53-12)36(52-11)33(47)23(5)56-40)38-41(6,59-38)15-14-26(42-49)20(2)16-24(17-30(50-9)51-10)35(21(3)27(44)18-29(45)57-28)58-39-34(48)31(43(7)8)32(46)22(4)55-39/h14-15,20-25,27-28,30-40,44,46-49H,13,16-19H2,1-12H3/b15-14-,42-26+/t20?,21?,22-,23+,24?,25?,27?,28?,31+,32-,33+,34-,35?,36+,37+,38?,39+,40+,41?/m0/s1 |
| InChIKey | DBZFIXIAMFCYMU-WFFOLKLASA-N |
| Literature Reference Author | A.NARANDA,N.LOPOTAR |
| Literature Reference Citation | J.ANTIBIOTICS,52,68(1999) |
| Literature Reference DOI | 10.7164/antibiotics.52.68 |
| Molecular Weight | 848.019 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU979 |