| Name |
Isoscoparin 2''-O-ferulate |
| Formula |
C32H30O14 |
| Mw |
638.16355567 |
| CAS RN |
|
| C_ID |
C00014106
, 
|
| InChIKey |
DHXHQFPPCWRLFJ-URYNRSAQNA-N |
| InChICode |
InChI=1S/C32H30O14/c1-42-21-9-14(3-6-16(21)34)4-8-25(38)46-32-30(41)28(39)24(13-33)45-31(32)27-19(37)12-23-26(29(27)40)18(36)11-20(44-23)15-5-7-17(35)22(10-15)43-2/h3-12,24,28,30-35,37,39-41H,13H2,1-2H3/b8-4+/t24-,28-,30+,31+,32-/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)CO)O)O)OC(=O)/C=C/c1cc(c(cc1)O)OC)O)c1cc(c(cc1)O)OC |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Bryonia sp. | Ref. |
|
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