Products 173658-86-1
CAS 173658-86-1 is the registry number for 3-O-Caffeoyl-5-O-feruloylquinic acid. Offered by: MedChemExpress. Available pack sizes: Get quote.
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4-dihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid (CAS 173658-86-1) is a chemical compound with the molecular formula C26H26O12 and a molecular weight of 530.5 g/mol. IUPAC name: (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4-dihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid. InChIKey: HFPFOWZKUHZLHL-VOHNXBSUSA-N.
| Molecular formula | C26H26O12 |
|---|---|
| Molecular weight | 530.5 g/mol |
| IUPAC name | (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4-dihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid |
| InChIKey | HFPFOWZKUHZLHL-VOHNXBSUSA-N |
| SMILES | COC1=C(C=CC(=C1)/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)(C(=O)O)O)O |
Computed by PubChem (NCBI)
Synonyms:
orb3179679