Details of Magnolidin
| IUPAC | 2-[[6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methoxy]-6-methyloxane-3,4,5-triol;(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
| Canonical Smiles | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCCC3=CC(=C(C=C3)O)O)O)OC4C(C(C(C(O4)C)O)O)O)O)O)O)O.C1=CC(=C(C=C1/C=C/C(=O)O)O)O |
| Inchi | NGCYQXCANCVPJY-QGLCECKVSA-N |
| PubChem ID | 5477035 |
| Smiles | CC1OC(OCC2OC(OCCc3ccc(O)c(O)c3)C(O)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28OCC2OC%28OCCc3ccc%28O%29c%28O%29c3%29C%28O%29C%28OC3OC%28C%29C%28O%29C%28O%29C3O%29C2O%29C%28O%29C%28O%29C1O/file?format=sdf&get3d=True -- CC1OC%28OCC2OC%28OCCc3ccc%28O%29c%28O%29c3%29C%28O%29C%28OC3OC%28C%29C%28O%29C%28O%29C3O%29C2O%29C%28O%29C%28O%29C1O could not be loaded.
| Class | Phenylpropanoids (C6-C3),Cinnamic acids and derivatives |
| Super Class | Phenylethanoids (C6-C2) |
| Pathways | Shikimates and Phenylpropanoids |
