Products 59252-87-8

CAS 59252-87-8 appears in our catalog under these names: Chikusetsusaponin Ib, Chikusetsusaponin Ib/ 98.34% (existing batch purity), Chikusetsusaponin Ib, Chikusetsusaponin Ib, 99.80%. Offered by: GLPBio, TargetMol, Chemat, MedChemExpress. Available pack sizes: 20mg, 1mg, 2mg, 5mg, 10mg, 25mg, 10 mg, 5 mg.

Structural formula: {0} (CAS {1})

Chikusetsusaponin-Ib is a triterpenoid saponin. It has a role as a metabolite.

Source: ChEBI

Identity
Molecular formulaC47H74O18
Molecular weight927.1 g/mol
IUPAC name(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4R,5S,6S)-5-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3,4-dihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyloxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChIKeyCGEOMQZMNZQKNQ-GNDIVNLPSA-N
SMILESC[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H](O8)CO)O)O)O)O

Computed by PubChem (NCBI)