| Name |
3-Caffeoyl-4-feruloylquinic acid |
| Formula |
C26H26O12 |
| Mw |
530.1424263 |
| CAS RN |
125132-81-2 |
| C_ID |
C00055232
|
| InChIKey |
RKAYMOSEFYVEJU-DRFAHUGVSA-N |
| InChICode |
InChI=1S/C26H26O12/c1-36-20-11-15(3-7-17(20)28)5-9-23(32)38-24-19(30)12-26(35,25(33)34)13-21(24)37-22(31)8-4-14-2-6-16(27)18(29)10-14/h2-11,19,21,24,27-30,35H,12-13H2,1H3,(H,33,34)/b8-4+,9-5+/t19-,21-,24-,26+/m1/s1 |
| SMILES |
OC1=C(OC)C=C(/C=C/C(O[C@H]2[C@H](OC(/C=C/C3=CC(O)=C(O)C=C3)=O)C[C@](O)(C(O)=O)C[C@H]2O)=O)C=C1 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus reticulata  | Ref. |
|
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