| SpectraBase Compound ID | Ey5xNFdQJEr |
|---|---|
| InChI | InChI=1S/C30H32O16/c1-27-10-29(40)18-8-30(27,28(18,26(45-27)46-29)11-42-23(38)12-2-4-14(31)5-3-12)44-25-22(37)21(36)20(35)17(43-25)9-41-24(39)13-6-15(32)19(34)16(33)7-13/h2-7,17-18,20-22,25-26,31-37,40H,8-11H2,1H3/t17-,18+,20-,21+,22-,25+,26+,27-,28-,29+,30-/m0/s1 |
| InChIKey | UXLQQSZFSBGUNY-WNYNKOJWSA-N |
| Mol Weight | 648.6 g/mol |
| Molecular Formula | C30H32O16 |
| Exact Mass | 648.169035 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xKGO8jnNHb |
|---|---|
| Name | GALLOYL-OXYPAEONIFLORIN |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32O16 |
| InChI | InChI=1S/C30H32O16/c1-27-10-29(40)18-8-30(27,28(18,26(45-27)46-29)11-42-23(38)12-2-4-14(31)5-3-12)44-25-22(37)21(36)20(35)17(43-25)9-41-24(39)13-6-15(32)19(34)16(33)7-13/h2-7,17-18,20-22,25-26,31-37,40H,8-11H2,1H3/t17-,18+,20-,21+,22-,25+,26+,27-,28-,29+,30-/m0/s1 |
| InChIKey | UXLQQSZFSBGUNY-WNYNKOJWSA-N |
| Literature Reference Author | H.MATSUDA,T.OHITA,A.KAWAGUCHI,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,49,69(2001) |
| Literature Reference DOI | 10.1248/cpb.49.69 |
| Molecular Weight | 648.574 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU31771 |