Details of Xyloccensin A
| IUPAC | [6-(furan-3-yl)-16-hydroxy-12-(2-methoxy-2-oxoethyl)-7,11,13,13-tetramethyl-18-(2-methylbutanoyloxy)-4-oxo-5,17-dioxapentacyclo[13.2.1.01,10.02,7.011,16]octadec-2-en-14-yl] 2-methylbutanoate |
| Canonical Smiles | CCC(C)C(=O)OC1C2C(C34C(CCC5(C3=CC(=O)OC5C6=COC=C6)C)C(C2(O4)O)(C(C1(C)C)CC(=O)OC)C)OC(=O)C(C)CC |
| Inchi | NWCINQVGVIKYAQ-UHFFFAOYSA-N |
| PubChem ID | 101967055 |
| Smiles | CCC(C)C(=O)OC1C2C(OC(=O)C(C)CC)C34OC2(O)C(C)(C(CC(=O)OC)C1(C)C)C3CCC1(C)C4=CC(=O)OC1c1ccoc1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CCC%28C%29C%28%3DO%29OC1C2C%28OC%28%3DO%29C%28C%29CC%29C34OC2%28O%29C%28C%29%28C%28CC%28%3DO%29OC%29C1%28C%29C%29C3CCC1%28C%29C4%3DCC%28%3DO%29OC1c1ccoc1/file?format=sdf&get3d=True -- CCC%28C%29C%28%3DO%29OC1C2C%28OC%28%3DO%29C%28C%29CC%29C34OC2%28O%29C%28C%29%28C%28CC%28%3DO%29OC%29C1%28C%29C%29C3CCC1%28C%29C4%3DCC%28%3DO%29OC1c1ccoc1 could not be loaded.
| Class | Limonoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |