| Name |
(6'''-O-(Delphinidin 3-O-(6''-O-p-coumaroyl-glucoside) 7-O-glucosyl)) (6''''-O-(kaempferol 3-O-glucoside, 7-O-xyloside, 4'-O-glucosyl))succinate |
| Formula |
C72H77O41 |
| Mw |
1597.39402697 |
| CAS RN |
270062-81-2 |
| C_ID |
C00014801
, 
|
| InChIKey |
ZGPLUMMVKACNSF-QHFBYBAWNA-O |
| InChICode |
InChI=1S/C72H76O41/c73-20-41-51(85)56(90)64(98)72(109-41)113-67-55(89)48-34(76)16-31(104-68-60(94)50(84)37(79)21-102-68)18-39(48)107-66(67)26-4-8-29(9-5-26)103-69-61(95)57(91)52(86)42(110-69)22-100-46(81)11-12-47(82)101-23-43-53(87)58(92)62(96)70(111-43)105-30-15-33(75)32-19-40(65(106-38(32)17-30)27-13-35(77)49(83)36(78)14-27)108-71-63(97)59(93)54(88)44(112-71)24-99-45(80)10-3-25-1-6-28(74)7-2-25/h1-10,13-19,37,41-44,50-54,56-64,68-73,79,84-88,90-98H,11-12,20-24H2,(H5-,74,75,76,77,78,80,83,89)/p+1/t37-,41+,42+,43+,44-,50-,51-,52-,53-,54-,56+,57+,58+,59+,60-,61-,62-,63-,64+,68-,69-,70-,71-,72+/m1/s1 |
| SMILES |
O=C(/C=C/c1ccc(O)cc1)OCC1O[C@@H](Oc2cc3c(O)cc(O[C@@H]4OC(COC(=O)CCC(=O)OCC5O[C@@H](Oc6ccc(-c7oc8cc(O[C@@H]9OC[C@@H](O)[C@H](O)C9O)cc(O)c8c(=O)c7O[C@@H]7OC(CO)[C@@H](O)[C@H](O)C7O)cc6)C(O)[C@@H](O)[C@@H]5O)[C@@H](O)[C@H](O)C4O)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 | Agapanthaceae | Agapanthus praecox | Ref. |
|
|
zoom in
|
