| SpectraBase Compound ID | 53or73d9ta6 |
|---|---|
| InChI | InChI=1S/C42H59N7O13/c1-23(2)13-11-9-7-8-10-12-14-34(52)47(5)32(22-50)40(57)44-24(3)38(55)43-21-35(53)48(6)36-27-15-16-33(51)28(20-27)29-17-26(19-31(37(29)54)49(61)62)18-30(42(59)60)46-39(56)25(4)45-41(36)58/h15-17,19-20,23-25,30,32,36,50-51,54H,7-14,18,21-22H2,1-6H3,(H,43,55)(H,44,57)(H,45,58)(H,46,56)(H,59,60)/t24-,25-,30?,32-,36?/m0/s1 |
| InChIKey | WFBZGMGSCAVZTQ-BYBSAUBOSA-N |
| Mol Weight | 870.0 g/mol |
| Molecular Formula | C42H59N7O13 |
| Exact Mass | 869.417085 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ExMmA3tF4V8 |
|---|---|
| Name | ARYLOMYCIN-B2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H59N7O13 |
| InChI | InChI=1S/C42H59N7O13/c1-23(2)13-11-9-7-8-10-12-14-34(52)47(5)32(22-50)40(57)44-24(3)38(55)43-21-35(53)48(6)36-27-15-16-33(51)28(20-27)29-17-26(19-31(37(29)54)49(61)62)18-30(42(59)60)46-39(56)25(4)45-41(36)58/h15-17,19-20,23-25,30,32,36,50-51,54H,7-14,18,21-22H2,1-6H3,(H,43,55)(H,44,57)(H,45,58)(H,46,56)(H,59,60)/t24-,25-,30?,32-,36?/m0/s1 |
| InChIKey | WFBZGMGSCAVZTQ-BYBSAUBOSA-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 | 869.970 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI4306 |