Name |
Picrioside A |
Formula |
C36H42O13 |
Mw |
682.26254143 |
CAS RN |
131870-91-2 |
C_ID |
C00020840
,
|
InChIKey |
HCKRLHVPHIPBKX-KJZZRKMPNA-N |
InChICode |
InChI=1S/C36H42O13/c1-14-7-22(39)28-19(11-37)6-5-18(9-21(14)28)16(3)34(44)47-24-8-15(2)26-23(40)10-20(29(26)33-27(24)17(4)35(45)49-33)13-46-36-32(43)31(42)30(41)25(12-38)48-36/h7,10,18,21,24-25,27,29-33,36-38,41-43H,3-6,8-9,11-13H2,1-2H3/t18-,21+,24+,25+,27-,29+,30-,31+,32+,33-,36-/m1/s1 |
SMILES |
C12=C(C[C@@H]([C@@H]3[C@H]([C@H]1C(=CC2=O)CO[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)OC(=O)C3=C)OC(=O)C(=C)[C@@H]1CCC(=C2[C@@H](C1)C(=CC2=O)C)CO)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Picris hieracioides | Ref. |
Plantae | Asteraceae | Picris hieracioides L.var.japonica Regel | Ref. |
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