Dipotassium Glycyrrhizinate structure

Dipotassium Glycyrrhizinate

dipotassium;(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxylato-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate

Also Known As: Dipotassium glycyrrhizinate|Glycyrrhizinate dipotassium|Neubormitin|Dipotassium glycyrrhizate|Neubormitin (TN)|Helenalin methacrylate|Dipotassiumglycyrrhizinate|Glycyrrhizic acid dipotassium|Glycyrrhizin Dipotassium Salt|MELAO AFTER SHAVE COLOGNE|Dipotassium glycyrrhizinate (JAN)|Glycyrrhizinate dipotassium [JAN]|Glycyrrhizic Acid Dipotassium Salt|Glycyrrhizic Acid dipotassium Salt|EINECS 272-296-1|GLYCYRRHIZICACIDDIPOTASSIUMSALT|Glycyrrhizicaciddipotassiumsalt,hydrate|GLYCYRRHIZINATE DIPOTASSIUM 0.5%|18beta-Glycyrrhizic acid dipotassium salt|THE SKIN HOUSE EGF COLLAGEN AMPOULE

CAS: 68797-35-3
Molecular Formula C42H60K2O16
Molecular Weight 898.31555 g/mol
LogP -6.4158
Topological Polar Surface Area 273.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 16
Rotatable Bonds 5
Exact Mass 898.31555
Monoisotopic Mass 898.31555
Heavy Atoms 60
Complexity 1720.0

Chemical Identifiers

CAS Number 68797-35-3
SMILES C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)[O-])O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)[O-])O)O)O)C)(C)C(=O)O.[K+].[K+]
InChIKey BIVBRWYINDPWKA-VLQRKCJKSA-L

Product Overview

Dipotassium Glycyrrhizinate (CAS 68797-35-3), with molecular formula C42H60K2O16 and molecular weight 898.31555 g/mol. IUPAC: dipotassium;(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxylato-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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