Details of Aloenin B
| IUPAC | [(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(4-methoxy-6-oxopyran-2-yl)-3-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate |
| Canonical Smiles | CC1=CC(=CC(=C1C2=CC(=CC(=O)O2)OC)OC3C(C(C(C(O3)CO)O)O)OC(=O)C=CC4=CC=C(C=C4)O)OC5C(C(C(C(O5)CO)O)O)O |
| Inchi | IZBGWXJOIXZDBF-WLFSTHIVSA-N |
| PubChem ID | 6442939 |
| Smiles | COc1cc(-c2c(C)cc(OC3OC(CO)C(O)C(O)C3O)cc2OC2OC(CO)C(O)C(O)C2OC(=O)C=Cc2ccc(O)cc2)oc(=O)c1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1cc%28-c2c%28C%29cc%28OC3OC%28CO%29C%28O%29C%28O%29C3O%29cc2OC2OC%28CO%29C%28O%29C%28O%29C2OC%28%3DO%29C%3DCc2ccc%28O%29cc2%29oc%28%3DO%29c1/file?format=sdf&get3d=True -- COc1cc%28-c2c%28C%29cc%28OC3OC%28CO%29C%28O%29C%28O%29C3O%29cc2OC2OC%28CO%29C%28O%29C%28O%29C2OC%28%3DO%29C%3DCc2ccc%28O%29cc2%29oc%28%3DO%29c1 could not be loaded.
| Class | |
| Super Class | |
| Pathways |
