| Name |
5-O-p-Coumaroylquinic acid
Cis-3-O-p-coumaroylquinic acid
5-p-Coumaroylquinic acid |
| Formula |
C16H18O8 |
| Mw |
338.10016755 |
| CAS RN |
32451-86-8 |
| C_ID |
C00052747
|
| InChIKey |
BMRSEYFENKXDIS-QHAYPTCMSA-N |
| InChICode |
InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@@](O)(C(=O)O)C[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Helianthus annuus  | Ref. |
| Plantae | Cruciferae | Raphanus sativus | Ref. |
| Plantae | Ericaceae | Rhododendron calophytum | Ref. |
| Plantae | Ericaceae | Rhododendron catawbiense | Ref. |
| Plantae | Ericaceae | Rhododendron fortunei | Ref. |
| Plantae | Ericaceae | Rhododendron kaempferi | Ref. |
| Plantae | Ericaceae | Rhododendron micranthum | Ref. |
| Plantae | Ericaceae | Rhododendron praevernum | Ref. |
| Plantae | Ericaceae | Rhododendron sp. | Ref. |
| Plantae | Ericaceae | Rhododendron ungernii | Ref. |
| Plantae | Solanaceae | Nicotiana tabacum | Ref. |
| - | - | Caffea sp. | Ref. |
|
|
zoom in
| Organism | Rhododendron ungernii |
|---|
| Reference | Jaiswal, R. et al., J. Mass. Spectrom. 47, (2012), 502-515. |
|---|
|
