![6-O-METHYL-3-O-DECLADINOSYL-3-O-[[5-QUINOLIN-3-YL)]PENT-3-ENOYL]8A-AZA-8A-HOMOERYTHROMYCIN_A](/api/spectrum/LyayuyLSwvC/structure.png?h=300&w=458 "6-O-METHYL-3-O-DECLADINOSYL-3-O-[[5-QUINOLIN-3-YL)]PENT-3-ENOYL]8A-AZA-8A-HOMOERYTHROMYCIN_A")
| SpectraBase Compound ID | D6nhwLibLRe |
|---|---|
| InChI | InChI=1S/C44H67N3O11/c1-12-34-44(8,53)38(50)29(6)40(51)46-25(2)23-43(7,54-11)39(58-42-36(49)33(47(9)10)21-26(3)55-42)27(4)37(28(5)41(52)56-34)57-35(48)20-16-13-17-30-22-31-18-14-15-19-32(31)45-24-30/h13-16,18-19,22,24-29,33-34,36-39,42,49-50,53H,12,17,20-21,23H2,1-11H3,(H,46,51)/b16-13+/t25-,26-,27+,28-,29-,33+,34-,36-,37+,38-,39-,42+,43-,44-/m1/s1 |
| InChIKey | KDLVFGCPSNEPDW-WZTPCXBCSA-N |
| Mol Weight | 814.0 g/mol |
| Molecular Formula | C44H67N3O11 |
| Exact Mass | 813.47756 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LyayuyLSwvC |
|---|---|
| Name | 6-O-METHYL-3-O-DECLADINOSYL-3-O-[[5-QUINOLIN-3-YL)]PENT-3-ENOYL]8A-AZA-8A-HOMOERYTHROMYCIN_A |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H67N3O11 |
| InChI | InChI=1S/C44H67N3O11/c1-12-34-44(8,53)38(50)29(6)40(51)46-25(2)23-43(7,54-11)39(58-42-36(49)33(47(9)10)21-26(3)55-42)27(4)37(28(5)41(52)56-34)57-35(48)20-16-13-17-30-22-31-18-14-15-19-32(31)45-24-30/h13-16,18-19,22,24-29,33-34,36-39,42,49-50,53H,12,17,20-21,23H2,1-11H3,(H,46,51)/b16-13+/t25-,26-,27+,28-,29-,33+,34-,36-,37+,38-,39-,42+,43-,44-/m1/s1 |
| InChIKey | KDLVFGCPSNEPDW-WZTPCXBCSA-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 | 814.029 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB465 |