| Name |
Delphinidin 3-(6-malonylglucoside)-5-glucoside |
| Formula |
C30H33O20 |
| Mw |
713.1565185 |
| CAS RN |
104078-08-2 |
| C_ID |
C00014811
, 
|
| InChIKey |
KKMPMQKPBOCHRG-FUNVOAFXNA-O |
| InChICode |
InChI=1S/C30H32O20/c31-7-17-22(39)24(41)26(43)29(49-17)47-15-4-10(32)3-14-11(15)5-16(28(46-14)9-1-12(33)21(38)13(34)2-9)48-30-27(44)25(42)23(40)18(50-30)8-45-20(37)6-19(35)36/h1-5,17-18,22-27,29-31,39-44H,6-8H2,(H4-,32,33,34,35,36,38)/p+1/t17-,18-,22-,23-,24+,25+,26-,27+,29-,30-/m1/s1 |
| SMILES |
O=C(O)CC(=O)OCC1O[C@@H](Oc2cc3c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(O)cc3[o+]c2-c2cc(O)c(O)c(O)c2)C(O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Cichorium intybus  | Ref. |
| Plantae | Caryophyllaceae | Dianthus caryophyllus | Ref. |
|
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