List of plants having phytochemicals: 4-(Methylthio)butyl thiocyanate
| Sl. No | Plant Name |
|---|---|
| 1 | Eruca vesicaria |
Details of 4-(Methylthio)butyl thiocyanate
| IUPAC | (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6S)-6-[(2S)-2-[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
| Canonical Smiles | CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)O)C)C)O)C)OC5C(C(C(C(O5)COC6C(C(C(C(O6)CO)O)O)O)O)O)O)C |
| Inchi | YIYRCZFIJNGYOG-QINBLQPGSA-N |
| PubChem ID | 86289140 |
| Smiles | COc1cc2oc(=O)ccc2cc1C=CC(C)(C)O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1cc2oc%28%3DO%29ccc2cc1C%3DCC%28C%29%28C%29O/file?format=sdf&get3d=True -- COc1cc2oc%28%3DO%29ccc2cc1C%3DCC%28C%29%28C%29O could not be loaded.
| Class | Dammarane and Protostane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |
