| 2D Structure | |
| CID | 118984432 |
| IUPAC Name | disodium;(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxylato-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 |
| InChI | InChI=1S/C42H62O16.2Na/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);;/q;2*+1/p-3/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;;/m0../s1 |
| InChI Key | KPQJOKRSYYJJEL-VLQRKCJKSA-K |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C42H59Na2O16- |
| Molecular Weight | 865.9 |
| synonyms | ['71277-79-7', 'Disodium glycyrrhizin', 'Disodium glycyrrhizate', 'UNII-L8Q0US0J7V', 'L8Q0US0J7V', 'CCRIS 1966', 'Glycyrrhizinic acid disodium salt', 'DISODIUM GLYCYRRHIZATE [WHO-DD]', 'alpha-D-Glucopyranosiduronic acid, (3-beta,20-beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl-2-O-beta-D-glucopyranuronosyl-, disodium salt', 'RefChem:200673', 'DISODIUM GLYCYRRHIZATE [INCI]', 'Disodium glycyrrhizinate', 'disodium;(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxylato-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', 'Glycyrrhizinate, disodium', 'Q27282842'] |
From Pubchem