CAS Registry Number®
53956-04-0
CAS Name
Ammonium glycyrrhizinate
Molecular Formula
C42H62O16.H3N
Other Names and Identifiers
InChI
InChI=1S/C42H62O16.H3N/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/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;/m0./s1
InChIKey
InChIKey=ILRKKHJEINIICQ-OOFFSTKBSA-N
SMILES
C[C@]12[C@@]([C@]3(C)[C@@](CC1)(C(C)(C)[C@@H](O[C@@H]4[C@H](O[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O4)CC3)[H])(C(=O)C=C6[C@@]2(C)CC[C@]7(C)[C@]6(C[C@](C(O)=O)(C)CC7)[H])[H].N
Canonical SMILES
O=C(O)C1OC(OC2C(OC(C(=O)O)C(O)C2O)OC3CCC4(C)C5C(=O)C=C6C7CC(C(=O)O)(C)CCC7(C)CCC6(C)C5(C)CCC4C3(C)C)C(O)C(O)C1O.N
Other Names for this Substance
- α-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-β-D-glucopyranuronosyl-, ammonium salt (1:1)
- α-D-Glucopyranosiduronic acid, (3β,20β)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-β-D-glucopyranuronosyl-, monoammonium salt
- 30-Noroleanane, α-D-glucopyranosiduronic acid deriv.
- Ammonium glycyrrhizinate
- Glycyrrhizic acid ammonium salt
- Glycyrrhizin ammonium salt
- Monoammonium glycyrrhizinate
- Glycyrram
- Glycamil
- 18β-Glycyrrhizic acid monoammonium salt
- Monoammonium glycyrrhizate
- Glycyrrhizin monoammonium salt
- Ammonium glycyrrhizate
- Glycyrrhizic acid monoammonium salt
- Glycymin
- NSC 2800
- NSC 35348
- Magnasweet
- (+)-Glycyram
- Monoammonium 18β-glycyrrhizinate
- Glycyron ammonium salt
- Glycyron monoammonium salt
- MagnaSweet MM 110F
Deleted or Replaced CAS Registry Numbers
97635-37-5, 1407-03-0, 42618-06-4, 52248-53-0, 202522-36-9, 1208112-20-2
