| SpectraBase Compound ID | J2LFJZ6tOHi |
|---|---|
| InChI | InChI=1S/C24H20O12/c25-8-16-18(28)19(29)20(30)24(35-16)36-22-12-7-15(23(31)32)33-13-5-11(27)6-14(17(12)13)34-21(22)9-1-3-10(26)4-2-9/h1-7,16,18-20,24-25,28-30H,8H2,(H2-,26,27,31,32)/p+1/t16-,18-,19+,20-,24+/m0/s1 |
| InChIKey | AXDSYHMPWOHFSW-WKLXTDFRSA-O |
| Mol Weight | 501.42 g/mol |
| Molecular Formula | C24H21O12 |
| Exact Mass | 501.103301 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LODYKvUeDmv |
|---|---|
| Name | 5-CARBOXYPYRANOPELARGONIDIN-3-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H21O12 |
| InChI | InChI=1S/C24H20O12/c25-8-16-18(28)19(29)20(30)24(35-16)36-22-12-7-15(23(31)32)33-13-5-11(27)6-14(17(12)13)34-21(22)9-1-3-10(26)4-2-9/h1-7,16,18-20,24-25,28-30H,8H2,(H2-,26,27,31,32)/p+1/t16-,18-,19+,20-,24+/m0/s1 |
| InChIKey | AXDSYHMPWOHFSW-WKLXTDFRSA-O |
| Literature Reference Author | O.M.ANDERSEN,T.FOSSEN,K.TORSKANGERPOLL,A.FOSSEN,U.HAUGE |
| Literature Reference Citation | PHYTOCHEM.,65,405(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2003.10.014 |
| Molecular Weight | 501.424 g/mol |
| Solvent | CF3CO2D:CD3OD=5:95 |
| Source File Reference | UWLU34587 |