Details of the Drug Excipient
General Information of Drug Inactive Ingredient (DIG) (ID: E00600)
| DIG Name |
Ammonium glycyrrhizate pentahydrate
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| Synonyms |
Ammonium glycyrrhizate pentahydrate; UNII-1Z1Y4QY887; 1Z1Y4QY887; 132215-36-2; Glycyrrhizin, ammoniated pentahydrate; alpha-D-glucopyranosiduronic acid, (3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-o-beta-D-glucopyranuronosyl-, monoammonium salt, pentahydrate; Q27253247
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| DIG Function |
Emulsifying agent; Flavoring agent
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| Formula |
C42H75NO21
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| Canonical 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.N.O.O.O.O.O
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| InChI |
1S/C42H62O16.H3N.5H2O/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;;;;;;/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);1H3;5*1H2/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;;;;;;/m0....../s1
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| InChIKey |
YTXJXSKSPIUKIU-TYWIYPESSA-N
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| Physicochemical Properties | Molecular Weight | 930 | Topological Polar Surface Area | 273 | |
| XlogP | N.A. | Complexity | 1730 | ||
| Heavy Atom Count | 64 | Rotatable Bond Count | 7 | ||
| Hydrogen Bond Donor Count | 14 | Hydrogen Bond Acceptor Count | 22 | ||