Details of Karenin
| IUPAC | (1S,2R,4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-4a-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-6a-carboxylic acid |
| Canonical Smiles | C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C(=O)O)COC(=O)/C=CC6=CC=C(C=C6)O |
| Inchi | AMRCFELIZUVBKY-APYUJPLLSA-N |
| PubChem ID | 6440661 |
| Smiles | C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C(=O)O)CC[C@@]2(COC(=O)C=Cc2ccc(O)cc2)CC[C@H]1C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%5BC%40%40H%5D1%5BC%40H%5D2C3%3DCC%5BC%40%40H%5D4%5BC%40%40%5D5%28C%29CC%5BC%40H%5D%28O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40%40%5D4%28C%29%5BC%40%5D3%28C%28%3DO%29O%29CC%5BC%40%40%5D2%28COC%28%3DO%29C%3DCc2ccc%28O%29cc2%29CC%5BC%40H%5D1C/file?format=sdf&get3d=True -- C%5BC%40%40H%5D1%5BC%40H%5D2C3%3DCC%5BC%40%40H%5D4%5BC%40%40%5D5%28C%29CC%5BC%40H%5D%28O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40%40%5D4%28C%29%5BC%40%5D3%28C%28%3DO%29O%29CC%5BC%40%40%5D2%28COC%28%3DO%29C%3DCc2ccc%28O%29cc2%29CC%5BC%40H%5D1C could not be loaded.
| Class | |
| Super Class | |
| Pathways |