5-O-Coumaroylquinic Acid
cas: 87099-71-6 — see every product listed under this CAS number, including other names
5-O-Coumaroylquinic Acid (CAS 87099-71-6) is a chemical reagent available from Chemat. Available pack sizes: 50mg, Get quote. Offered by: TRC, MedChemExpress.
| brand | TRC |
|---|---|
| catalog number | TRC-C899975-50MG |
| cas | 87099-71-6 |
| size | 50mg |
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Available pack sizes
| brand | size | price | |
|---|---|---|---|
| TRC | 50mg | price on request | |
| MedChemExpress | Get quote | price on request |
properties
| purity | No data |
|---|---|
| delivery time | To be confirmed by Chemat |
3-p-coumaroylquinic acid is a cinnamate ester obtained by formal condensation of the carboxy group of 4-coumaric acid with the 3-hydroxy group of quinic acid. It has a role as a metabolite. It is a cinnamate ester and a cyclitol carboxylic acid. It is functionally related to a (-)-quinic acid and a 4-coumaric acid.
Source: ChEBI
| Molecular formula | C16H18O8 |
|---|---|
| Molecular weight | 338.31 g/mol |
| IUPAC name | (1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid |
| InChIKey | BMRSEYFENKXDIS-QHAYPTCMSA-N |
| SMILES | C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC=C(C=C2)O)O)O |
Computed by PubChem (NCBI)