| SpectraBase Compound ID | p0lvzGv1dw |
|---|---|
| InChI | InChI=1S/C27H22O18/c28-9-1-6(2-10(29)16(9)32)24(39)45-27-22(38)23-19(35)13(43-27)5-42-25(40)7-3-11(30)17(33)20(36)14(7)15-8(26(41)44-23)4-12(31)18(34)21(15)37/h1-4,13,19,22-23,27-38H,5H2/t13-,19-,22-,23+,27+/m1/s1 |
| InChIKey | TUSDEZXZIZRFGC-XIGLUPEJSA-N |
| Mol Weight | 634.46 g/mol |
| Molecular Formula | C27H22O18 |
| Exact Mass | 634.080614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JbYdEUqF1aG |
|---|---|
| Name | CORILAGIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H22O18 |
| InChI | InChI=1S/C27H22O18/c28-9-1-6(2-10(29)16(9)32)24(39)45-27-22(38)23-19(35)13(43-27)5-42-25(40)7-3-11(30)17(33)20(36)14(7)15-8(26(41)44-23)4-12(31)18(34)21(15)37/h1-4,13,19,22-23,27-38H,5H2/t13-,19-,22-,23+,27+/m1/s1 |
| InChIKey | TUSDEZXZIZRFGC-XIGLUPEJSA-N |
| Literature Reference Author | M.A.M.NAWWAR,S.A.M.HUSSEIN,I.MERFORT |
| Literature Reference Citation | PHYTOCHEM.,36,793(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89820-9 |
| Molecular Weight | 634.461 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMS25752 |