| SpectraBase Compound ID | GKwa8O7iH1B |
|---|---|
| InChI | InChI=1S/C28H39NO6/c1-15(2)12-22-26-18(5)17(4)14-21-13-16(3)8-9-23(34-19(6)30)24(35-20(7)31)10-11-25(32)28(21,26)27(33)29-22/h10-11,13-15,18,21-24,26H,8-9,12H2,1-7H3,(H,29,33)/b11-10-,16-13-/t18-,21+,22+,23+,24?,26+,28-/m1/s1 |
| InChIKey | HRURGVWLTOSBPC-TXKSMWCMSA-N |
| Mol Weight | 485.6 g/mol |
| Molecular Formula | C28H39NO6 |
| Exact Mass | 485.277738 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AFVKkvbuI0L |
|---|---|
| Name | 17,18-DI-O-ACETYL-ASPOCHALASIN-C |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H39NO6 |
| InChI | InChI=1S/C28H39NO6/c1-15(2)12-22-26-18(5)17(4)14-21-13-16(3)8-9-23(34-19(6)30)24(35-20(7)31)10-11-25(32)28(21,26)27(33)29-22/h10-11,13-15,18,21-24,26H,8-9,12H2,1-7H3,(H,29,33)/b11-10-,16-13-/t18-,21+,22+,23+,24?,26+,28-/m1/s1 |
| InChIKey | HRURGVWLTOSBPC-TXKSMWCMSA-N |
| Literature Reference Author | K.A.ALVI,B.NAIR,H.PU,R.URSINO,C.GALLO,U.MOCEK |
| Literature Reference Citation | J.ORG.CHEM.,62,2148(1997) |
| Literature Reference DOI | 10.1021/jo962321s |
| Molecular Weight | 485.621 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS23602 |