Details of PHYSALIN A
| IUPAC | (1S,2S,3R,5R,6S,7R,14R,15S,18R,21S,22R)-5,7,18-trihydroxy-1,14,21-trimethyl-25-methylidene-4,20,23-trioxaheptacyclo[20.3.1.12,5.03,18.03,21.06,15.09,14]heptacosa-8,11-diene-13,19,24,27-tetrone |
| Canonical Smiles | CC12CC(C3(C45C1C(=O)C(O4)(C6C(CCC5(C(=O)O3)O)C7(C(=CC6O)CC=CC7=O)C)O)C)OC(=O)C2=C |
| Inchi | VELDODQHYQSJOF-RPKVKFPNSA-N |
| PubChem ID | 44577487 |
| Smiles | C=C1C(=O)OC2CC1(C)C1C(=O)C3(O)OC14C(O)(CCC1C3C(O)C=C3C=CCC(=O)C31C)C(=O)OC24C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%3DC1C%28%3DO%29OC2CC1%28C%29C1C%28%3DO%29C3%28O%29OC14C%28O%29%28CCC1C3C%28O%29C%3DC3C%3DCCC%28%3DO%29C31C%29C%28%3DO%29OC24C/file?format=sdf&get3d=True -- C%3DC1C%28%3DO%29OC2CC1%28C%29C1C%28%3DO%29C3%28O%29OC14C%28O%29%28CCC1C3C%28O%29C%3DC3C%3DCCC%28%3DO%29C31C%29C%28%3DO%29OC24C could not be loaded.
| Class | Ergostane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |
