| SpectraBase Compound ID | 6Lx7NNLJsmY |
|---|---|
| InChI | InChI=1S/C31H56N2O10/c1-12-22-31(9,39)25(36)20(7)32-27(37)16(3)15-30(8,40-13-2)26(18(5)23(34)19(6)28(38)42-22)43-29-24(35)21(33(10)11)14-17(4)41-29/h16-22,24-26,29,35-36,39H,12-15H2,1-11H3,(H,32,37)/t16-,17-,18+,19-,20-,21+,22-,24-,25-,26-,29+,30-,31-/m1/s1 |
| InChIKey | VSTCVGBVKHVCNJ-DZKRKKNISA-N |
| Mol Weight | 616.8 g/mol |
| Molecular Formula | C31H56N2O10 |
| Exact Mass | 616.393496 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Ssojx07Lfk |
|---|---|
| Name | 6-O-ETHYL-3-OXO-9A-AZA-9A-HOMOERYTHROMYCIN_A |
| Compound Number | 5B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H56N2O10 |
| InChI | InChI=1S/C31H56N2O10/c1-12-22-31(9,39)25(36)20(7)32-27(37)16(3)15-30(8,40-13-2)26(18(5)23(34)19(6)28(38)42-22)43-29-24(35)21(33(10)11)14-17(4)41-29/h16-22,24-26,29,35-36,39H,12-15H2,1-11H3,(H,32,37)/t16-,17-,18+,19-,20-,21+,22-,24-,25-,26-,29+,30-,31-/m1/s1 |
| InChIKey | VSTCVGBVKHVCNJ-DZKRKKNISA-N |
| Literature Reference Author | S.ALIHODZIC,A.FAJDETIC,G.KOBREHEL,G.LAZAREVSKI,S.MUTAK,D.PAV LOVIC,V.STIMAC,H.CIP |
| Literature Reference Citation | J.ANTIBIOTICS,59,753(2006) |
| Literature Reference DOI | 10.1038/ja.2006.100 |
| Molecular Weight | 616.793 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB470 |