(-)-Chicoric acid
(2R,3R)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid
Also Known As: Chicoric acid|Cichoric Acid|L-Chicoric acid|(-)-Chicoric acid|dicaffeoyltartaric acid|ChicoricAcid|L-Cichoric acid|D-Chicoric acid|Chicoric|no translation|L-Chicoricacid|1-chicoricacid|Cichoric-Acid|l-Chicoric-acid|(-)-L-Chicoric acid|L-DCTA|PENTAERYTHRITOL|Dicaffeoyl tartaric acid|Chicoric acid, (-)-|CICHORINIC ACID|( -)-Chicoric acid|( ?)-Chicoric acid|ECH PURPUREA PE|Dicaffeoyl-L-tartaric acid|Echinacea Purpurea powder|L-CA|ECH ANGUSTIFOLIA PE|trans-Caffeoyltartaric acid|HIV-1 Integrase Inhibitor|(-)-CICHORIC ACID|Echinacea Purpurea Root Extract|CHICORIC ACID [USP-RS]
| Molecular Formula | C22H18O12 |
|---|---|
| Molecular Weight | 474.07983 g/mol |
| LogP | 1.2284 |
| Topological Polar Surface Area | 208.12 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.07983 |
| Monoisotopic Mass | 474.07983 |
| Heavy Atoms | 34 |
| Complexity | 1072.9701 |
Chemical Identifiers
| CAS Number | 52248-48-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1/C=C/C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)/C=C/C2=CC(=C(C=C2)O)O)C(=O)O)O)O |
Product Overview
(-)-Chicoric acid (CAS 52248-48-3), with molecular formula C22H18O12 and molecular weight 474.07983 g/mol. IUPAC: (2R,3R)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid.
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