| Name |
Isoscoparin 2''-(6-(E)-p-coumaroylglucoside) |
| Formula |
C37H38O18 |
| Mw |
770.20581441 |
| CAS RN |
99445-33-7 |
| C_ID |
C00006334
, 
|
| InChIKey |
PLLYYRRPIIWFON-JMVQXDAFNA-N |
| InChICode |
InChI=1S/C37H38O18/c1-50-22-10-16(5-8-18(22)40)21-11-19(41)27-23(52-21)12-20(42)28(31(27)46)35-36(33(48)29(44)24(13-38)53-35)55-37-34(49)32(47)30(45)25(54-37)14-51-26(43)9-4-15-2-6-17(39)7-3-15/h2-12,24-25,29-30,32-40,42,44-49H,13-14H2,1H3/b9-4+/t24-,25+,29+,30+,32+,33-,34+,35-,36+,37-/m0/s1 |
| SMILES |
c1(c(c(c2c(c1)oc(cc2=O)c1cc(c(cc1)O)OC)O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(cc1)O)O)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Cucumis sativus  | Ref. |
| Plantae | Poaceae | Oryza sativa | Ref. |
|
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