| SpectraBase Compound ID | 17abmnEflm6 |
|---|---|
| InChI | InChI=1S/C42H61N3O10/c1-13-29-22-43-32-23(3)21-41(8,50-12)36(54-39-34(30(44(10)11)20-24(4)51-39)53-38(48)28-18-16-15-17-19-28)26(6)33(46)27(7)37(47)52-31(14-2)42(9)35(25(32)5)45(29)40(49)55-42/h13,15-19,23-27,29-31,34-36,39H,1,14,20-22H2,2-12H3/t23-,24-,25+,26+,27-,29+,30+,31-,34-,35-,36-,39+,41-,42-/m1/s1 |
| InChIKey | ADBWYBMEGNDFCV-FJBOXEPRSA-N |
| Mol Weight | 768.0 g/mol |
| Molecular Formula | C42H61N3O10 |
| Exact Mass | 767.435695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1TmvfHavKxY |
|---|---|
| Name | ERYTHROMYCIN-A-TRICYCLE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H61N3O10 |
| InChI | InChI=1S/C42H61N3O10/c1-13-29-22-43-32-23(3)21-41(8,50-12)36(54-39-34(30(44(10)11)20-24(4)51-39)53-38(48)28-18-16-15-17-19-28)26(6)33(46)27(7)37(47)52-31(14-2)42(9)35(25(32)5)45(29)40(49)55-42/h13,15-19,23-27,29-31,34-36,39H,1,14,20-22H2,2-12H3/t23-,24-,25+,26+,27-,29+,30+,31-,34-,35-,36-,39+,41-,42-/m1/s1 |
| InChIKey | ADBWYBMEGNDFCV-FJBOXEPRSA-N |
| Literature Reference Author | R.F.KEYES,J.J.CARTER,X.ZHANG,Z.MA |
| Literature Reference Citation | ORG.LETTERS,7,847(2005) |
| Literature Reference DOI | 10.1021/ol047406r |
| Molecular Weight | 767.960 g/mol |
| Sample ID | 42417 |
| Solvent | CDCl3 |