| SpectraBase Compound ID | 8sQl8QK0Us0 |
|---|---|
| InChI | InChI=1S/C42H60N6O11/c1-24(2)13-11-9-7-8-10-12-14-35(52)47(5)32(23-49)40(56)44-25(3)38(54)43-22-36(53)48(6)37-28-16-18-34(51)30(21-28)29-19-27(15-17-33(29)50)20-31(42(58)59)46-39(55)26(4)45-41(37)57/h15-19,21,24-26,31-32,37,49-51H,7-14,20,22-23H2,1-6H3,(H,43,54)(H,44,56)(H,45,57)(H,46,55)(H,58,59)/t25-,26-,31?,32-,37?/m0/s1 |
| InChIKey | YFSXYWAZCKMYJN-PXOHEMITSA-N |
| Mol Weight | 825.0 g/mol |
| Molecular Formula | C42H60N6O11 |
| Exact Mass | 824.432007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HRXCWzBFxUC |
|---|---|
| Name | ARYLOMYCIN-A2 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H60N6O11 |
| InChI | InChI=1S/C42H60N6O11/c1-24(2)13-11-9-7-8-10-12-14-35(52)47(5)32(23-49)40(56)44-25(3)38(54)43-22-36(53)48(6)37-28-16-18-34(51)30(21-28)29-19-27(15-17-33(29)50)20-31(42(58)59)46-39(55)26(4)45-41(37)57/h15-19,21,24-26,31-32,37,49-51H,7-14,20,22-23H2,1-6H3,(H,43,54)(H,44,56)(H,45,57)(H,46,55)(H,58,59)/t25-,26-,31?,32-,37?/m0/s1 |
| InChIKey | YFSXYWAZCKMYJN-PXOHEMITSA-N |
| Literature Reference Author | A.HOELTZEL,D.G.SCHMID,G.J.NICHOLSON,S.STEVANOVIC,J.SCHIMANA, K.GEBHARDT,H.P.FIEDL |
| Literature Reference Citation | J.ANTIBIOTICS,55,571(2002) |
| Literature Reference DOI | 10.7164/antibiotics.55.571 |
| Molecular Weight | 824.972 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI4305 |