| Name |
cis-4-O-Caffeoylquinic acid |
| Formula |
C16H18O9 |
| Mw |
354.09508217 |
| CAS RN |
87099-76-1 |
| C_ID |
C00064669
|
| InChIKey |
GYFFKZTYYAFCTR-XYXZIBEBSA-N |
| InChICode |
InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)/b4-2-/t11-,12-,14-,16+/m1/s1 |
| SMILES |
O(C(/C=C\C1=CC(O)=C(O)C=C1)=O)[C@@H]2[C@H](O)C[C@](C(O)=O)(O)C[C@H]2O;O=C(O)C1(O)CC(O)C(OC(=O)C=CC2=CC=C(O)C(O)=C2)C(O)C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Berberidaceae | Berberis microphylia | Ref. |
|
|
zoom in
| Organism | Berberis microphylia |
|---|
| Reference | Ruiz,A. et al, J. Chromatography A,1281,38-45 (2013) |
|---|
|
