CAS 84680-75-1 appears in our catalog under these names: Astragaloside i, 95%, Astragaloside I, >95% (HPLC), Astragaloside I, Astragaloside I/ 99.64% (existing batch purity), Astragaloside I. Offered by: Combi-blocks, TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: 10mg, 5mg, 25mg, 20mg, 50mg, 100mg, 500mg, 2mg.
Astragaloside I is a triterpenoid saponin that is cycloastragenol glycosylated at positions 3 and 6 by 2,3-di-O-acetyl-beta-D-xylosyl and beta-D-glucosyl residues respectively. It has a role as a plant metabolite. It is a beta-D-glucoside, a pentacyclic triterpenoid, a member of oxolanes, a triterpenoid saponin and a monosaccharide derivative. It is functionally related to a cycloastragenol.
Source: ChEBI
| Molecular formula | C45H72O16 |
|---|---|
| Molecular weight | 869.0 g/mol |
| IUPAC name | [(2S,3R,4S,5R)-3-acetyloxy-5-hydroxy-2-[[(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-4-yl] acetate |
| InChIKey | KXHCYYSIAXMSPA-OOCCOBHWSA-N |
| SMILES | CC(=O)O[C@H]1[C@@H](CO[C@H]([C@@H]1OC(=O)C)O[C@H]2CC[C@]34C[C@]35CC[C@@]6([C@H]([C@H](C[C@]6([C@@H]5C[C@@H]([C@H]4C2(C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)O)[C@]8(CC[C@H](O8)C(C)(C)O)C)C)O |
Computed by PubChem (NCBI)