List of plants having phytochemicals: Senegin II


Sl. No Plant Name
1Polygala senega

Details of Senegin II



General Information
IUPAC (2S,3R,4S,4aR,6aR,6bR,8aS,12aS,14aR,14bR)-8a-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-5-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]oxy-4-hydroxy-6-methyloxan-2-yl]oxycarbonyl-2-hydroxy-6b-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
Canonical Smiles C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H]([C@H](O[C@H]2OC(=O)[C@@]34CC[C@@]5(C(=CC[C@H]6[C@]5(CC[C@@H]7[C@@]6(C[C@@H]([C@@H]([C@@]7(C)C(=O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O)C)C)[C@@H]3CC(CC4)(C)C)CO)C)OC(=O)/C=C/C9=CC(=C(C=C9)OC)OC)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)O
Inchi MNXFXXWQAAMVMW-JEIATDTDSA-N
PubChem ID 11953920
Smiles COc1ccc(/C=C/C(=O)O[C@@H]2[C@H](O)[C@@H](O[C@@H]3O[C@@H](C)[C@H](O[C@@H]4OC[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@@H](O)[C@H]3O)[C@H](OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(C(=O)O)[C@@H]6CC[C@@]5(C)[C@]3(CO)CC4)O[C@@H]2C)cc1OC
2D Structure
3D Structure
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1ccc%28/C%3DC/C%28%3DO%29O%5BC%40%40H%5D2%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%5BC%40%40H%5D3O%5BC%40%40H%5D%28C%29%5BC%40H%5D%28O%5BC%40%40H%5D4OC%5BC%40%40H%5D%28O%5BC%40%40H%5D5O%5BC%40H%5D%28CO%29%5BC%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D5O%29%5BC%40H%5D%28O%29%5BC%40H%5D4O%29%5BC%40%40H%5D%28O%29%5BC%40H%5D3O%29%5BC%40H%5D%28OC%28%3DO%29%5BC%40%5D34CCC%28C%29%28C%29C%5BC%40H%5D3C3%3DCC%5BC%40%40H%5D5%5BC%40%40%5D6%28C%29C%5BC%40H%5D%28O%29%5BC%40H%5D%28O%5BC%40%40H%5D7O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40%40%5D%28C%29%28C%28%3DO%29O%29%5BC%40%40H%5D6CC%5BC%40%40%5D5%28C%29%5BC%40%5D3%28CO%29CC4%29O%5BC%40%40H%5D2C%29cc1OC/file?format=sdf&get3d=True -- COc1ccc%28/C%3DC/C%28%3DO%29O%5BC%40%40H%5D2%5BC%40H%5D%28O%29%5BC%40%40H%5D%28O%5BC%40%40H%5D3O%5BC%40%40H%5D%28C%29%5BC%40H%5D%28O%5BC%40%40H%5D4OC%5BC%40%40H%5D%28O%5BC%40%40H%5D5O%5BC%40H%5D%28CO%29%5BC%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D5O%29%5BC%40H%5D%28O%29%5BC%40H%5D4O%29%5BC%40%40H%5D%28O%29%5BC%40H%5D3O%29%5BC%40H%5D%28OC%28%3DO%29%5BC%40%5D34CCC%28C%29%28C%29C%5BC%40H%5D3C3%3DCC%5BC%40%40H%5D5%5BC%40%40%5D6%28C%29C%5BC%40H%5D%28O%29%5BC%40H%5D%28O%5BC%40%40H%5D7O%5BC%40H%5D%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29%5BC%40H%5D7O%29%5BC%40%40%5D%28C%29%28C%28%3DO%29O%29%5BC%40%40H%5D6CC%5BC%40%40%5D5%28C%29%5BC%40%5D3%28CO%29CC4%29O%5BC%40%40H%5D2C%29cc1OC could not be loaded.
Classification
Class Oleanane triterpenoids
Super Class Triterpenoids
Pathways Terpenoids