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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H33O6.K.2H2O
Molecular Weight 492.6441
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MEXRENOATE POTASSIUM

SMILES

O.O.[K+].[H][C@@]12CC[C@@](O)(CCC([O-])=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])[C@@H](CC4=CC(=O)CC[C@]34C)C(=O)OC

InChI

InChIKey=QADGUEZDHAWIQG-BXKVGZNMSA-M
InChI=1S/C24H34O6.K.2H2O/c1-22-8-4-15(25)12-14(22)13-16(21(28)30-3)20-17(22)5-9-23(2)18(20)6-10-24(23,29)11-7-19(26)27;;;/h12,16-18,20,29H,4-11,13H2,1-3H3,(H,26,27);;2*1H2/q;+1;;/p-1/t16-,17+,18+,20-,22+,23+,24-;;;/m1.../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MEXRENOATE POTASSIUM
USAN  
USAN  
Official Name English
MEXRENOATE POTASSIUM [USAN]
Common Name English
7-Methyl 21-potassium 17-hydroxy-3-oxo-17α-pregn-4-ene-7α,21-dicarboxylate dihydrate
Common Name English
SC-26714
Code English
PREGN-4-ENE-7,21-DICARBOXYLIC ACID, 17-HYDROXY-3-OXO-, 7-METHYL ESTER, MONOPOTASSIUM SALT, DIHYDRATE, (7.ALPHA.,17.ALPHA.)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID90195757
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
PUBCHEM
23675009
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110977
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
CAS
43169-54-6
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
FDA UNII
G5R44ZQ1DN
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
SMS_ID
100000081161
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
MESH
C014680
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY
NCI_THESAURUS
C170173
Created by admin on Fri Dec 15 15:26:23 UTC 2023 , Edited by admin on Fri Dec 15 15:26:23 UTC 2023
PRIMARY