Details of Aloin A
| IUPAC | (10S)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one |
| Canonical Smiles | C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO |
| Inchi | AFHJQYHRLPMKHU-OSYMLPPYSA-N |
| PubChem ID | 12305761 |
| Smiles | OCc1cc(O)c2c(O)c3c(O)cccc3c(C3OC(CO)C(O)C(O)C3O)c2c1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/OCc1cc%28O%29c2c%28O%29c3c%28O%29cccc3c%28C3OC%28CO%29C%28O%29C%28O%29C3O%29c2c1/file?format=sdf&get3d=True -- OCc1cc%28O%29c2c%28O%29c3c%28O%29cccc3c%28C3OC%28CO%29C%28O%29C%28O%29C3O%29c2c1 could not be loaded.
| Class | Anthraquinones and anthrones |
| Super Class | Polycyclic aromatic polyketides |
| Pathways | Polyketides |
