| Name |
Vescalin |
| Formula |
C27H20O18 |
| Mw |
632.06496384 |
| CAS RN |
34112-28-2 |
| C_ID |
C00058091
|
| InChIKey |
PPUHUWSVCUJGTD-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C27H20O18/c28-2-5-14(31)23-24-20(37)12-11(27(42)45-24)9(18(35)22(39)19(12)36)8-10(26(41)44-23)7(16(33)21(38)17(8)34)6-3(25(40)43-5)1-4(29)13(30)15(6)32/h1,5,14,20,23-24,28-39H,2H2 |
| SMILES |
O=C1OC(CO)C(O)C2OC(=O)c3c(c(O)c(O)c(O)c3-c3c(O)c(O)c(O)c4c3C(=O)OC2C4O)-c2c1cc(O)c(O)c2O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fagaceae | Castanea sativa  | Ref. |
|
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