| Name |
Cheiranthoside IX
Cheirotoxin |
| Formula |
C35H52O15 |
| Mw |
712.33062099 |
| CAS RN |
7044-33-9 |
| C_ID |
C00032810
, 
|
| InChIKey |
CAYUJEAJKPLCAV-MBKWYUEXNA-N |
| InChICode |
InChI=1S/C35H52O15/c1-16-29(50-31-27(42)25(40)24(39)22(13-36)49-31)26(41)28(43)30(47-16)48-18-3-8-33(15-37)20-4-7-32(2)19(17-11-23(38)46-14-17)6-10-35(32,45)21(20)5-9-34(33,44)12-18/h11,15-16,18-22,24-31,36,39-45H,3-10,12-14H2,1-2H3/t16-,18+,19-,20+,21-,22-,24-,25+,26+,27-,28-,29+,30+,31+,32-,33+,34+,35+/m1/s1 |
| SMILES |
C1[C@@H](C[C@@]2([C@](C1)([C@@H]1[C@@H](CC2)[C@@]2([C@](CC1)([C@H](CC2)C1=CC(=O)OC1)C)O)C=O)O)O[C@@H]1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Brassicaceae | Cheiranthus cheiri  | Ref. |
| Plantae | Cruciferae | Erysimum cheiranthoides | Ref. |
|
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