4,5-Di-O-Caffeoylquinic Acid Methyl Ester
Request a quote| Catalog Number | ACM188742805 |
| CAS | 188742-80-5 |
| Structure | ![{[CurrentData.Name]}](https://resource.alfa-chemistry.com/structure/188742-80-5.gif) |
| IUPAC Name | methyl (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate |
| Molecular Weight | 530.5 |
| Molecular Formula | C26H26O12 |
| Canonical SMILES | COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O |
| Inchi | InChI=1S/C26H26O12/c1-36-25(34)26(35)12-20(31)24(38-23(33)9-5-15-3-7-17(28)19(30)11-15)21(13-26)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h2-11,20-21,24,27-31,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24+,26-/m1/s1 |
| InChIKey | PKJBSZTYNDRXEQ-GMGOHGFSSA-N |
| Purity | 98% |
| Appearance | Powder |
Ask Your Question
