| Name |
Cyanidin 3-(6''-p-coumarylglucoside)-5-4''',6'''-dimalonylglucoside) |
| Formula |
C42H41O24 |
| Mw |
929.19877724 |
| CAS RN |
|
| C_ID |
C00006827
, 
|
| InChIKey |
JJJMVXFRCMSVEA-YCKVDOBINA-O |
| InChICode |
InChI=1S/C42H40O24/c43-19-5-1-17(2-6-19)3-8-31(51)59-15-27-34(54)35(55)37(57)41(64-27)63-26-12-21-24(61-39(26)18-4-7-22(45)23(46)9-18)10-20(44)11-25(21)62-42-38(58)36(56)40(66-33(53)14-30(49)50)28(65-42)16-60-32(52)13-29(47)48/h1-12,27-28,34-38,40-42,54-58H,13-16H2,(H5-,43,44,45,46,47,48,49,50,51)/p+1/t27-,28+,34-,35+,36-,37-,38-,40-,41-,42-/m1/s1 |
| SMILES |
c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(cc1)O)O)O)O)c1ccc(c(c1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)COC(=O)CC(=O)O)OC(=O)CC(=O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Agastache aurantiaca | Ref. |
| Plantae | Labiatae | Clinopodium vulgare | Ref. |
| Plantae | Labiatae | Glechoma hederacea  | Ref. |
| Plantae | Labiatae | Salvia castanea | Ref. |
| Plantae | Labiatae | Salvia greggii | Ref. |
| Plantae | Labiatae | Salvia lineata | Ref. |
| Plantae | Labiatae | Salvia multicaulis | Ref. |
| Plantae | Labiatae | Stachys macrantha | Ref. |
| Plantae | Labiatae | Stachys officinalis | Ref. |
|
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