| Name |
Delphinidin 3-[2-(6-feruloylglucoside)-6-p-coumaroylglucoside]-5-(6-malonylglucoside) |
| Formula |
C55H57O30 |
| Mw |
1197.29346549 |
| CAS RN |
379232-02-7 |
| C_ID |
C00014786
, 
|
| InChIKey |
GTFFIZJORYFPKL-JAGGYHHUNA-O |
| InChICode |
InChI=1S/C55H56O30/c1-75-33-12-23(4-9-28(33)58)6-11-40(64)76-19-35-43(67)47(71)50(74)54(83-35)85-52-48(72)45(69)37(20-77-39(63)10-5-22-2-7-25(56)8-3-22)84-55(52)81-34-17-27-31(79-51(34)24-13-29(59)42(66)30(60)14-24)15-26(57)16-32(27)80-53-49(73)46(70)44(68)36(82-53)21-78-41(65)18-38(61)62/h2-17,35-37,43-50,52-55,67-74H,18-21H2,1H3,(H6-,56,57,58,59,60,61,62,63,64,66)/p+1/t35-,36-,37-,43+,44+,45+,46+,47+,48+,49-,50-,52-,53-,54+,55-/m1/s1 |
| SMILES |
COc1cc(/C=C/C(=O)OCC2O[C@@H](OC3[C@H](Oc4cc5c(O[C@@H]6OC(COC(=O)CC(=O)O)[C@@H](O)[C@H](O)C6O)cc(O)cc5[o+]c4-c4cc(O)c(O)c(O)c4)OC(COC(=O)/C=C/c4ccc(O)cc4)[C@@H](O)[C@@H]3O)C(O)[C@@H](O)[C@@H]2O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Ajuga reptans  | Ref. |
|
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