| Name |
Helveticoside |
| Formula |
C29H42O9 |
| Mw |
534.28288294 |
| CAS RN |
630-64-8 |
| C_ID |
C00003625
, 
|
| InChIKey |
QBILRDAMJUPXCX-BSAPTFCMNA-N |
| InChICode |
InChI=1S/C29H42O9/c1-16-25(33)22(31)12-24(37-16)38-18-3-8-27(15-30)20-4-7-26(2)19(17-11-23(32)36-14-17)6-10-29(26,35)21(20)5-9-28(27,34)13-18/h11,15-16,18-22,24-25,31,33-35H,3-10,12-14H2,1-2H3/t16-,18+,19-,20+,21-,22-,24-,25+,26-,27+,28+,29+/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]1C[C@H]([C@H]([C@H](O1)C)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cruciferae | Erysimum cheiranthoides | Ref. |
| Plantae | Cruciferae | Erysimum crepidifolium | Ref. |
| Plantae | Cruciferae | Erysimum diffusum  | Ref. |
| Plantae | Cruciferae | Erysimum helveticum | Ref. |
| Plantae | Cruciferae | Hesperis matronalis | Ref. |
|
|
zoom in
| Organism | Hesperis matronalis |
|---|
| Reference | Aldrich Library of FT-IR Spectra,1st edn.,2,(1985),1071A |
|---|
|
