CAS 1415-73-2 appears in our catalog under these names: Aloin A, Aloin A, >95% (HPLC), Aloin, Aloin/ 99.89% (existing batch purity), Aloin . Offered by: Chemat Brand, TRC, Mikromol, GLPBio, TargetMol. Available pack sizes: on request, 100mg, 25mg, 50mg, 4x25mg, 20mg, 10mM (in 1ml dmso), 1g .
Aloin A is a C-glycosyl compound that is beta-D-glucopyranose in which the anomeric hydroxy group is replaced by a 4,5-dihydroxy-2-(hydroxymethyl)-10-oxo-9,10-dihydroanthracen-9-yl moiety (the 9S diastereoisomer). It has a role as a metabolite and a laxative. It is a C-glycosyl compound, a member of phenols, a cyclic ketone and a member of anthracenes.
Source: ChEBI
| Molecular formula | C21H22O9 |
|---|---|
| Molecular weight | 418.4 g/mol |
| IUPAC name | (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 |
| InChIKey | AFHJQYHRLPMKHU-OSYMLPPYSA-N |
| SMILES | C1=CC2=C(C(=C1)O)C(=O)C3=C([C@H]2[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C=C(C=C3O)CO |
Computed by PubChem (NCBI)