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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H59O16.2K.H
Molecular Weight 899.1128
Optical Activity UNSPECIFIED
Defined Stereocenters 19 / 19
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GLYCYRRHIZINATE DIPOTASSIUM

SMILES

[H+].[K+].[K+].[H][C@@]7(O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@@H]1O[C@@]2([H])CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])C(=O)C=C5[C@]6([H])C[C@](C)(CC[C@]6(C)CC[C@@]45C)C([O-])=O)C2(C)C)C([O-])=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]7O)C([O-])=O

InChI

InChIKey=BIVBRWYINDPWKA-VLQRKCJKSA-L
InChI=1S/C42H62O16.2K/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-2/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;;/m0../s1

HIDE SMILES / InChI

Molecular Formula C42H59O16
Molecular Weight 819.9083
Charge -3
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 19 / 19
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H
Molecular Weight 1.0079
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:13:59 UTC 2023
Edited
by admin
on Fri Dec 15 16:13:59 UTC 2023
Record UNII
CA2Y0FE3FX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GLYCYRRHIZINATE DIPOTASSIUM
Common Name English
DIPOTASSIUM GLYCYRRHIZATE [INCI]
Common Name English
DIPOTASSIUM GLYCYRRHIZINATE [JAN]
Common Name English
Dipotassium Glycyrrhizate [WHO-DD]
Common Name English
.ALPHA.-D-GLUCOPYRANOSIDURONIC ACID,(3.BETA.,20.BETA.)-20-CARBOXY-11-OXO-30-NOROLEAN-12-EN-3-YL 2-O-.BETA.-D-GLUCOPYRANURONOSYL-, POTASSIUM SALT (1:2)
Common Name English
DIPOTASSIUM GLYCYRRHIZATE
INCI   MART.   WHO-DD  
INCI  
Official Name English
DIPOTASSIUM GLYCYRRHIZINATE
JAN  
Common Name English
GLYCYRRHIZIC ACID DIPOTASSIUM
Common Name English
DIPOTASSIUM (3.BETA.,20.BETA.)-20-CARBOXY-11-OXO-30-NOROLEAN-12-EN-3-YL-2-O-.BETA.-D-GLUCOPYRANURONOSYL-.ALPHA.-D-GLUCOPYRANOSIDURONATE
Common Name English
DIPOTASSIUM GLYCYRRHIZATE [MART.]
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
272-296-1
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
DRUG BANK
DBSALT002693
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
CAS
68039-19-0
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
NON-SPECIFIC STOICHIOMETRY
NCI_THESAURUS
C80931
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
DAILYMED
CA2Y0FE3FX
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
PUBCHEM
656852
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
ChEMBL
CHEMBL441687
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
SMS_ID
100000085835
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
EPA CompTox
DTXSID501015077
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
FDA UNII
CA2Y0FE3FX
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
NCI_THESAURUS
C45678
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
CONCEPT Industrial Aid
RXCUI
1367264
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY RxNorm
CAS
68797-35-3
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
EVMPD
SUB22293
Created by admin on Fri Dec 15 16:13:59 UTC 2023 , Edited by admin on Fri Dec 15 16:13:59 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> CONSTITUENT ALWAYS PRESENT
Related Record Type Details
ACTIVE MOIETY