| Name |
Trifloroside |
| Formula |
C35H42O20 |
| Mw |
782.22694379 |
| CAS RN |
53823-10-2 |
| C_ID |
C00010796
, 
|
| InChIKey |
RMBMLYUFYBZPCX-RJAIAJHUNA-N |
| InChICode |
InChI=1S/C35H42O20/c1-5-17-18-9-10-46-31(44)20(18)12-48-33(17)55-35-30(50-16(4)39)29(49-15(3)38)28(23(53-35)13-47-14(2)37)54-32(45)19-7-6-8-21(24(19)40)51-34-27(43)26(42)25(41)22(11-36)52-34/h5-8,12,17-18,22-23,25-30,33-36,40-43H,1,9-11,13H2,2-4H3/t17-,18-,22-,23-,25+,26-,27+,28+,29-,30+,33-,34+,35-/m0/s1 |
| SMILES |
C=C[C@H]1[C@H](O[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(=O)c3cccc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3O)[C@H](OC(C)=O)C2OC(C)=O)OC=C2C(=O)OCC[C@H]21 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Gentianaceae | Gentiana scabra  | Ref. |
| Plantae | Gentianaceae | Gentiana triflora | Ref. |
| Plantae | Gentianaceae | Gentiana trifolia | Ref. |
|
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