Details of THONNINGIANIN-B
| IUPAC | (10S,11R,12R,13S,15R)-13-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione |
| Canonical Smiles | C1C2C(C(C(C(O2)OC3=CC(=C(C(=C3)O)C(=O)CCC4=CC=CC=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5C6=C(C(=C(C=C6C(=O)O1)O)O)O)O)O)O |
| Inchi | UJNCWORGHSATHA-XWSAIMBSSA-N |
| PubChem ID | 10101397 |
| Smiles | O=C1OCC2OC(Oc3cc(O)c(C(=O)CCc4ccccc4)c(O)c3)C(O)C(O)C2OC(=O)c2cc(O)c(O)c(O)c2-c2c1cc(O)c(O)c2O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/O%3DC1OCC2OC%28Oc3cc%28O%29c%28C%28%3DO%29CCc4ccccc4%29c%28O%29c3%29C%28O%29C%28O%29C2OC%28%3DO%29c2cc%28O%29c%28O%29c%28O%29c2-c2c1cc%28O%29c%28O%29c2O/file?format=sdf&get3d=True -- O%3DC1OCC2OC%28Oc3cc%28O%29c%28C%28%3DO%29CCc4ccccc4%29c%28O%29c3%29C%28O%29C%28O%29C2OC%28%3DO%29c2cc%28O%29c%28O%29c%28O%29c2-c2c1cc%28O%29c%28O%29c2O could not be loaded.
| Class | |
| Super Class | |
| Pathways |