| Name |
(Delphinidin 3-gentiobios-6'''-yl)(apigenin 7-glucos-6''-yl)malonate |
| Formula |
C51H51O29 |
| Mw |
1127.25160067 |
| CAS RN |
157501-11-6 |
| C_ID |
C00006880
, 
|
| InChIKey |
BPEOHZRDZDSMRD-MTYCEURXNA-O |
| InChICode |
InChI=1S/C51H50O29/c52-19-3-1-17(2-4-19)28-12-25(56)37-24(55)9-21(10-30(37)75-28)74-50-46(69)43(66)40(63)33(79-50)15-72-36(60)13-35(59)71-14-32-39(62)42(65)45(68)49(78-32)73-16-34-41(64)44(67)47(70)51(80-34)77-31-11-22-23(54)7-20(53)8-29(22)76-48(31)18-5-26(57)38(61)27(58)6-18/h1-12,32-34,39-47,49-51,62-70H,13-16H2,(H6-,52,53,54,55,56,57,58,61)/p+1/t32-,33-,34-,39-,40-,41-,42+,43+,44+,45-,46+,47-,49-,50-,51-/m1/s1 |
| SMILES |
c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)Oc1cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)O)O)O)O)O)O)O)O)O)c1cc(c(c(c1)O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Pontederiaceae | Eichhornia crassipes  | Ref. |
|
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