| Name |
Ciliatoside A
(-)-Ciliatoside A |
| Formula |
C36H40O19 |
| Mw |
776.2163791 |
| CAS RN |
303084-57-3 |
| C_ID |
C00033721
, 
|
| InChIKey |
WTNBRCRYRLAZFO-RHRIQTDLNA-N |
| InChICode |
InChI=1S/C36H40O19/c1-45-21-6-15-16(7-22(21)46-2)30(17-8-47-32(43)25(17)24(15)14-3-4-20-23(5-14)53-13-52-20)54-35-31(55-34-29(42)27(40)19(38)10-49-34)36(44,12-51-35)11-50-33-28(41)26(39)18(37)9-48-33/h3-7,18-19,26-29,31,33-35,37-42,44H,8-13H2,1-2H3/t18-,19-,26+,27-,28+,29+,31-,33-,34-,35-,36-/m0/s1 |
| SMILES |
c12c(c(c3c(c1O[C@H]1[C@@H]([C@](CO1)(O)CO[C@@H]1OC[C@@H]([C@H]([C@H]1O)O)O)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O)cc(c(c3)OC)OC)c1cc3c(cc1)OCO3)C(=O)OC2 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Acanthaceae | Justicia ciliata | Ref. |
|
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