| SpectraBase Compound ID | 721J4xwSLh6 |
|---|---|
| InChI | InChI=1S/C36H40O9/c1-18-8-9-21-32(42)27(44-6)16-29(41)36(21,30-15-25(40)31-24(39)12-20(37)13-26(31)45-30)22(18)17-35(43)19(2)23(38)14-28-33(3,4)10-7-11-34(28,35)5/h8,12-13,15-16,21-22,28,37,39,43H,2,7,9-11,14,17H2,1,3-6H3/t21-,22+,28-,34-,35+,36-/m0/s1 |
| InChIKey | YDNJPPNAMOXTDQ-HIKWZQKJSA-N |
| Mol Weight | 616.7 g/mol |
| Molecular Formula | C36H40O9 |
| Exact Mass | 616.267233 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 42ZQW9JAEg7 |
|---|---|
| Name | DICHROSTACHINE_K |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H40O9 |
| InChI | InChI=1S/C36H40O9/c1-18-8-9-21-32(42)27(44-6)16-29(41)36(21,30-15-25(40)31-24(39)12-20(37)13-26(31)45-30)22(18)17-35(43)19(2)23(38)14-28-33(3,4)10-7-11-34(28,35)5/h8,12-13,15-16,21-22,28,37,39,43H,2,7,9-11,14,17H2,1,3-6H3/t21-,22+,28-,34-,35+,36-/m0/s1 |
| InChIKey | YDNJPPNAMOXTDQ-HIKWZQKJSA-N |
| Literature Reference Author | C.LONG,L.MARCOURT,R.RAUX,B.DAVID,C.GAU,C.MENENDEZ,M.GAO,M.F. LAROCHE,P.SCHAMBEL,C |
| Literature Reference Citation | J.NAT.PROD.,72,1804(2009) |
| Literature Reference DOI | 10.1021/np900095z |
| Molecular Weight | 616.708 g/mol |
| Sample ID | 33695 |
| Solvent | CD3OD:CDCl3=9:1 |