| Name |
Isovitexin 7-O-(6'''-caffeoyl)-beta-D-glucopyranoside |
| Formula |
C36H36O18 |
| Mw |
756.19016435 |
| CAS RN |
165746-63-4 |
| C_ID |
C00014076
, 
|
| InChIKey |
DPXQMYRXAMWBGO-UEFWNIFENA-N |
| InChICode |
InChI=1S/C36H36O18/c37-12-23-28(43)31(46)33(48)35(52-23)27-22(11-21-26(30(27)45)19(41)10-20(51-21)15-3-5-16(38)6-4-15)53-36-34(49)32(47)29(44)24(54-36)13-50-25(42)8-2-14-1-7-17(39)18(40)9-14/h1-11,23-24,28-29,31-40,43-49H,12-13H2/b8-2+/t23-,24-,28-,29-,31+,32+,33-,34-,35+,36-/m1/s1 |
| SMILES |
c1(oc2c(c(=O)c1)c(c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1cc(c(cc1)O)O)O)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)c1ccc(cc1)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Bryonia dioica  | Ref. |
|
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