For research use only. Not for therapeutic Use.
| Catalog Number | R054869 |
| CAS Number | 1187945-72-7 |
| Synonyms | 5-(2-Carboxyethyl)-2-methoxyphenyl β-D-Glucopyranosiduronic Acid; Dihydroisoferulic Acid 3-O-Glucuronide; |
| Molecular Formula | C16H20O10 |
| Purity | ≥95% |
| Storage | -20°C |
| IUPAC Name | (2S,3S,4S,5R,6S)-6-[5-(2-carboxyethyl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid |
| InChI | InChI=1S/C16H20O10/c1-24-8-4-2-7(3-5-10(17)18)6-9(8)25-16-13(21)11(19)12(20)14(26-16)15(22)23/h2,4,6,11-14,16,19-21H,3,5H2,1H3,(H,17,18)(H,22,23)/t11-,12-,13+,14-,16+/m0/s1 |
| InChIKey | OSJGZCUHTGTJHT-JHZZJYKESA-N |
| SMILES | COC1=C(C=C(C=C1)CCC(=O)O)OC2C(C(C(C(O2)C(=O)O)O)O)O |
