| Name |
Apigenin 7-glucuronide-4'-(6''-malonylglucoside) |
| Formula |
C30H30O19 |
| Mw |
694.13812878 |
| CAS RN |
89483-03-4 |
| C_ID |
C00004196
, 
|
| InChIKey |
KWPZKEPPMDOLFK-SUTWEJJMNA-N |
| InChICode |
InChI=1S/C30H30O19/c31-13-5-12(46-30-26(41)23(38)24(39)27(49-30)28(42)43)6-16-20(13)14(32)7-15(47-16)10-1-3-11(4-2-10)45-29-25(40)22(37)21(36)17(48-29)9-44-19(35)8-18(33)34/h1-7,17,21-27,29-31,36-41H,8-9H2,(H,33,34)(H,42,43)/t17-,21-,22-,23+,24+,25-,26-,27-,29-,30-/m1/s1 |
| SMILES |
c1(cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O)O)O[C@@H]1O[C@H]([C@H]([C@@H]([C@H]1O)O)O)C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Centaurea cyanus  | Ref. |
|
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