| Name |
Quercetin 3-(2'''-caffeylsophoroside) |
| Formula |
C36H36O20 |
| Mw |
788.17999359 |
| CAS RN |
162556-38-9 |
| C_ID |
C00005977
, 
|
| InChIKey |
NWOCYFGKUMMLPD-SUWRVRJGNA-N |
| InChICode |
InChI=1S/C36H36O20/c37-11-22-26(46)29(49)33(54-24(45)6-2-13-1-4-16(40)18(42)7-13)35(52-22)56-34-30(50)27(47)23(12-38)53-36(34)55-32-28(48)25-20(44)9-15(39)10-21(25)51-31(32)14-3-5-17(41)19(43)8-14/h1-10,22-23,26-27,29-30,33-44,46-47,49-50H,11-12H2/b6-2+/t22-,23-,26+,27+,29+,30-,33-,34+,35-,36-/m0/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)c(O)c1)OC1C(O)[C@H](O)C(CO)O[C@H]1OC1[C@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)OC(CO)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Ranunculaceae | Ranunculus spp. | Ref. |
|
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