| SpectraBase Compound ID | 1CI3W3sbfQr |
|---|---|
| InChI | InChI=1S/C37H61N3O11/c1-12-27-37(8,46)31(43)24(6)33(44)39-20(2)18-36(7,47-11)32(51-35-29(42)26(40(9)10)16-21(3)48-35)22(4)30(23(5)34(45)49-27)50-28(41)17-25-14-13-15-38-19-25/h13-15,19-24,26-27,29-32,35,42-43,46H,12,16-18H2,1-11H3,(H,39,44)/t20-,21-,22+,23-,24-,26+,27-,29-,30+,31-,32-,35+,36-,37-/m1/s1 |
| InChIKey | PBQZNRBDLUZFAP-UZSWFSKASA-N |
| Mol Weight | 723.9 g/mol |
| Molecular Formula | C37H61N3O11 |
| Exact Mass | 723.43061 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ESYUQmt99nz |
|---|---|
| Name | 6-O-METHYL-3-O-DECLADINOSYL-3-O-(PYRIDIN-3-YL)ACETYL-8A-AZA-8A-HOMOERYTHROMYCIN_A |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H61N3O11 |
| InChI | InChI=1S/C37H61N3O11/c1-12-27-37(8,46)31(43)24(6)33(44)39-20(2)18-36(7,47-11)32(51-35-29(42)26(40(9)10)16-21(3)48-35)22(4)30(23(5)34(45)49-27)50-28(41)17-25-14-13-15-38-19-25/h13-15,19-24,26-27,29-32,35,42-43,46H,12,16-18H2,1-11H3,(H,39,44)/t20-,21-,22+,23-,24-,26+,27-,29-,30+,31-,32-,35+,36-,37-/m1/s1 |
| InChIKey | PBQZNRBDLUZFAP-UZSWFSKASA-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 | 723.905 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB462 |