| Name |
Clerodendrin |
| Formula |
C27H26O17 |
| Mw |
622.11699941 |
| CAS RN |
119738-57-7 |
| C_ID |
C00035270
, 
|
| InChIKey |
SJFTVAAHLRFBST-OYBQOXGENA-N |
| InChICode |
InChI=1S/C27H26O17/c28-9-3-1-8(2-4-9)13-7-12(30)15-11(29)5-10(6-14(15)41-13)40-27-23(19(34)18(33)22(43-27)25(38)39)44-26-20(35)16(31)17(32)21(42-26)24(36)37/h1-7,16-23,26-29,31-35H,(H,36,37)(H,38,39)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1 |
| SMILES |
O=C(O)[C@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Medicago sativa  | Ref. |
| Plantae | Verbenaceae | Lippia alba | Ref. |
|
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