| SpectraBase Compound ID | JqX2j9hbApu |
|---|---|
| InChI | InChI=1S/C36H30O13/c1-12-10-20(39)25-26(22(12)13(2)37)29(43)18-8-6-16(27(41)23(18)30(25)44)17-7-9-19-24(28(17)42)33(46)35-21(40)11-34(5,47)31(14(3)48-15(4)38)36(35,49-35)32(19)45/h6-10,14,31,33,39,41-42,46-47H,11H2,1-5H3/t14-,31+,33-,34+,35-,36+/m1/s1 |
| InChIKey | JJRMFXHFOOMZIG-GANHTAAKSA-N |
| Mol Weight | 670.6 g/mol |
| Molecular Formula | C36H30O13 |
| Exact Mass | 670.168641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BgkBnLWzyBL |
|---|---|
| Name | JULICHROME_Q_3.5 |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H30O13 |
| InChI | InChI=1S/C36H30O13/c1-12-10-20(39)25-26(22(12)13(2)37)29(43)18-8-6-16(27(41)23(18)30(25)44)17-7-9-19-24(28(17)42)33(46)35-21(40)11-34(5,47)31(14(3)48-15(4)38)36(35,49-35)32(19)45/h6-10,14,31,33,39,41-42,46-47H,11H2,1-5H3/t14-,31+,33-,34+,35-,36+/m1/s1 |
| InChIKey | JJRMFXHFOOMZIG-GANHTAAKSA-N |
| Literature Reference Author | K.A.SHAABAN,M.SHAABAN,I.GRUEN-WOLLNY,A.MAIER,H.H.FIEBIG,H.LA ATSCH |
| Literature Reference Citation | J.NAT.PROD.,70,1545(2007) |
| Literature Reference DOI | 10.1021/np070196h |
| Molecular Weight | 670.626 g/mol |
| Sample ID | 31627 |
| Solvent | CDCl3 |