| SpectraBase Compound ID | BTAFSnKRvit |
|---|---|
| InChI | InChI=1S/C31H53N5O7/c1-11-20(6)31(8)30(42)35(10)25(19(4)5)29(41)34(9)21(7)26(38)32-15-14-24(37)43-23(17-18(2)3)28(40)36-16-12-13-22(36)27(39)33-31/h18-23,25H,11-17H2,1-10H3,(H,32,38)(H,33,39)/t20?,21-,22-,23+,25-,31-/m0/s1 |
| InChIKey | VZOKXBZTQQZSRO-SVUMYUKMSA-N |
| Mol Weight | 607.8 g/mol |
| Molecular Formula | C31H53N5O7 |
| Exact Mass | 607.394499 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5uvYb1B9hYH |
|---|---|
| Name | DESTRUXIN-B;CYCLO-(2-(R)-HYDROXY-4-METHYLPENTANOYL-L-PROLYL-L-ISOLEUCYL-N-METHYL-L-VALYL-N-METHYL-L-ALANYL-BETA-ALANYL) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H53N5O7 |
| InChI | InChI=1S/C31H53N5O7/c1-11-20(6)31(8)30(42)35(10)25(19(4)5)29(41)34(9)21(7)26(38)32-15-14-24(37)43-23(17-18(2)3)28(40)36-16-12-13-22(36)27(39)33-31/h18-23,25H,11-17H2,1-10H3,(H,32,38)(H,33,39)/t20?,21-,22-,23+,25-,31-/m0/s1 |
| InChIKey | VZOKXBZTQQZSRO-SVUMYUKMSA-N |
| Literature Reference Author | L.BUCHWALDT,J.S.JENSEN |
| Literature Reference Citation | PHYTOCHEM.,30,2311(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83638-2 |
| Molecular Weight | 607.791 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI25365 |