| SpectraBase Compound ID | AxAcPLxSkMn |
|---|---|
| InChI | InChI=1S/C56H95N3O17/c1-33-18-15-20-37(5)52(36(4)17-13-11-9-10-12-14-24-59-55(57)58-8)75-54(72)38(6)21-16-19-34(2)46(64)30-47(65)39(7)44(62)23-22-35(3)49(67)32-56(73)53(71)48(66)29-43(76-56)28-42(74-51(70)31-50(68)69)26-40(60)25-41(61)27-45(33)63/h9-10,15-16,18-21,34-37,39-49,52-53,60-67,71,73H,11-14,17,22-32H2,1-8H3,(H,68,69)(H3,57,58,59)/b10-9+,19-16+,20-15+,33-18+,38-21+ |
| InChIKey | BQEFTEXUBGKSRY-MZPMPKHUSA-N |
| Mol Weight | 1082.4 g/mol |
| Molecular Formula | C56H95N3O17 |
| Exact Mass | 1081.666149 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6GIWb8C8rdE |
|---|---|
| Name | AZALOMYCIN-F4A |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H95N3O17 |
| InChI | InChI=1S/C56H95N3O17/c1-33-18-15-20-37(5)52(36(4)17-13-11-9-10-12-14-24-59-55(57)58-8)75-54(72)38(6)21-16-19-34(2)46(64)30-47(65)39(7)44(62)23-22-35(3)49(67)32-56(73)53(71)48(66)29-43(76-56)28-42(74-51(70)31-50(68)69)26-40(60)25-41(61)27-45(33)63/h9-10,15-16,18-21,34-37,39-49,52-53,60-67,71,73H,11-14,17,22-32H2,1-8H3,(H,68,69)(H3,57,58,59)/b10-9+,19-16+,20-15+,33-18+,38-21+ |
| InChIKey | BQEFTEXUBGKSRY-MZPMPKHUSA-N |
| Literature Reference Author | G.YUAN,H.LIN,C.WANG,K.HONG,Y.LIU,J.LI |
| Literature Reference Citation | MAGN.RES.CHEM.,49,30(2011) |
| Literature Reference DOI | 10.1002/mrc.2697 |
| Molecular Weight | 1082.380 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT12802 |