MERCUMATILIN SODIUM

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H12HgO5.C7H8N4O2.Na.HO
Molecular Weight	680.99
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[OH-].[Na+].CN1C2=C(NC=N2)C(=O)N(C)C1=O.COC(C[Hg+])CC3=CC=CC4=C3OC(=O)C(=C4)C([O-])=O

InChI

InChIKey=KLJDKONKMMIPDT-UHFFFAOYSA-L

InChI=1S/C14H13O5.C7H8N4O2.Hg.Na.H2O/c1-8(18-2)6-9-4-3-5-10-7-11(13(15)16)14(17)19-12(9)10;1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;;;/h3-5,7-8H,1,6H2,2H3,(H,15,16);3H,1-2H3,(H,8,9);;;1H2/q;;2*+1;/p-2

HIDE SMILES / InChI

Molecular Formula	C7H8N4O2
Molecular Weight	180.164
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C14H12HgO5
Molecular Weight	460.83
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	HO
Molecular Weight	17.0073
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 `Mon Mar 31 19:27:21 GMT 2025` Edited by `admin` on `Mon Mar 31 19:27:21 GMT 2025`
Record UNII	2F2Y83SYO6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MERCUMATILIN SODIUM

Official Name

English

CUMERTILIN SODIUM

Preferred Name

English

MERCUMALLYLIC ACID SODIUM SALT COMPOUND WITH THEOPHYLLINE [MI]

Common Name

English

MERCURATE(1-), (3-(3-CARBOXYLATO-2-OXO-2H-1-BENZOPYRAN-8-YL)-2-METHOXYPROPYL)(3,7-DIHYDRO-1,3-DIMETHYL-1H-PURINE-2,6-DIONE-.KAPPA.N7,.KAPPA.O6)HYDROXY-, SODIUM (1:1), (T-4)-

Common Name

English

mercumatilin sodium [INN]

Common Name

English

MERCUMALLYLIC ACID THEOPHYLLINE SODIUM

Common Name

English

Code System Code Type Description

INN

155