| SpectraBase Compound ID | ArWUPMYZPTi |
|---|---|
| InChI | InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9-/t21-,22-,26+,27+,29+,31+,32-/m0/s1 |
| InChIKey | PSNOPSMXOBPNNV-WFOIFSGKSA-N |
| Mol Weight | 655.2 g/mol |
| Molecular Formula | C35H43ClN2O8 |
| Exact Mass | 654.270794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JJfdddim39D |
|---|---|
| Name | CRYPTOPHYCIN-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H43ClN2O8 |
| InChI | InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9-/t21-,22-,26+,27+,29+,31+,32-/m0/s1 |
| InChIKey | PSNOPSMXOBPNNV-WFOIFSGKSA-N |
| Literature Reference Author | G.TRIMURTULU,I.OHTANI,G.M.L.PATTERSON,R.E.MOORE,T.H.CORBETT, F.A.VALERIOTE,L.DEMC |
| Literature Reference Citation | J.AM.CHEM.SOC.,116,4729(1994) |
| Literature Reference DOI | 10.1021/ja00090a020 |
| Molecular Weight | 655.188 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI648 |