| SpectraBase Compound ID | KL3W5H62yhD |
|---|---|
| InChI | InChI=1S/C27H30O16/c1-40-17-9-12(3-6-16(17)41-25-22(34)21(33)20(32)18(11-28)42-25)4-7-19(31)43-23(24(35)36)27(39,26(37)38)10-13-2-5-14(29)15(30)8-13/h2-9,18,20-23,25,28-30,32-34,39H,10-11H2,1H3,(H,35,36)(H,37,38)/b7-4+/t18-,20+,21+,22-,23+,25-,27-/m0/s1 |
| InChIKey | AVWHRYVRVICHPX-QTODRWNGSA-N |
| Mol Weight | 610.52 g/mol |
| Molecular Formula | C27H30O16 |
| Exact Mass | 610.153385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CZBrWQXtGN |
|---|---|
| Name | SHOMASIDE_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O16 |
| InChI | InChI=1S/C27H30O16/c1-40-17-9-12(3-6-16(17)41-25-22(34)21(33)20(32)18(11-28)42-25)4-7-19(31)43-23(24(35)36)27(39,26(37)38)10-13-2-5-14(29)15(30)8-13/h2-9,18,20-23,25,28-30,32-34,39H,10-11H2,1H3,(H,35,36)(H,37,38)/b7-4+/t18-,20+,21+,22-,23+,25-,27-/m0/s1 |
| InChIKey | AVWHRYVRVICHPX-QTODRWNGSA-N |
| Literature Reference Author | A.IWANAGA,G.KUSANO,T.WARASHINA,T.MIYASE |
| Literature Reference Citation | J.NAT.PROD.,73,573(2010) |
| Literature Reference DOI | 10.1021/np900675n |
| Molecular Weight | 610.526 g/mol |
| Sample ID | 35187 |
| Solvent | CD3OD |