| SpectraBase Compound ID | DeO3xSiO3qL |
|---|---|
| InChI | InChI=1S/C26H32N6O11/c27-26(28)29-11-3-7-16(30-22(38)14-5-1-9-18(34)20(14)36)23(39)31-17(24(40)41)8-4-12-32(13-33)43-25(42)15-6-2-10-19(35)21(15)37/h1-2,5-6,9-10,13,16-17,34-37H,3-4,7-8,11-12H2,(H,30,38)(H,31,39)(H,40,41)(H4,27,28,29)/t16-,17-/m1/s1 |
| InChIKey | JANBVBCLMZUUHR-IAGOWNOFSA-N |
| Mol Weight | 604.6 g/mol |
| Molecular Formula | C26H32N6O11 |
| Exact Mass | 604.212906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8y2QrjccgxL |
|---|---|
| Name | MIRUBACTIN |
| Compound Number | 1-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32N6O11 |
| InChI | InChI=1S/C26H32N6O11/c27-26(28)29-11-3-7-16(30-22(38)14-5-1-9-18(34)20(14)36)23(39)31-17(24(40)41)8-4-12-32(13-33)43-25(42)15-6-2-10-19(35)21(15)37/h1-2,5-6,9-10,13,16-17,34-37H,3-4,7-8,11-12H2,(H,30,38)(H,31,39)(H,40,41)(H4,27,28,29)/t16-,17-/m1/s1 |
| InChIKey | JANBVBCLMZUUHR-IAGOWNOFSA-N |
| Literature Reference Author | T.W.GIESSEN,K.B.FRANKE,T.A.KNAPPE,F.I.KRAAS,M.BOSELLO,X.XIE, U.LINNE,M.A.MARAHIEL |
| Literature Reference Citation | J.NAT.PROD.,75,905(2012) |
| Literature Reference DOI | 10.1021/np300046k |
| Molecular Weight | 604.574 g/mol |
| Sample ID | 40408 |
| Solvent | DMSO-D6 |