MERPHYRIN

Details

Stereochemistry	MIXED
Molecular Formula	C34H34N4O6.Hg.2Na
Molecular Weight	841.23
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Hg++].CC(O)c1c(C)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(C)c5C(C)O)c(C)c4CCC([O-])=O)c(CCC([O-])=O)c3C

InChI

InChIKey=MSWKATKSSLJVEX-HRSUBPLTSA-J

InChI=1S/C34H38N4O6.Hg.2Na/c1-15-21(7-9-31(41)42)27-14-28-22(8-10-32(43)44)16(2)24(36-28)12-29-34(20(6)40)18(4)26(38-29)13-30-33(19(5)39)17(3)25(37-30)11-23(15)35-27;;;/h11-14,19-20,39-40H,7-10H2,1-6H3,(H4,35,36,37,38,41,42,43,44);;;/q;+2;2*+1/p-4/b23-11-,24-12-,25-11-,26-13-,27-14-,28-14-,29-12-,30-13-;;;

HIDE SMILES / InChI

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	C34H32N4O6
Molecular Weight	592.6411
Charge	-4
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Hg
Molecular Weight	200.59
Charge	2
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 22:13:22 GMT 2025` Edited by `admin` on `Mon Mar 31 22:13:22 GMT 2025`
Record UNII	3937ZYJ7S1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-66393

Preferred Name

English

MERPHYRIN

Common Name

English

MERCURI-HEMATOPORPHYRIN DISODIUM SALT

Common Name

English

M. H

Common Name

English

MERPHYRIN [MI]

Common Name

English

MERCURATE(2-), (7,12-BIS(1-HYDROXYETHYL)-3,8,13,17-TETRAMETHYL-21H,23H-PORPHINE-2,18-DIPROPANOATO(4-)-.KAPPA.N21,.KAPPA.N22,.KAPPA.N23,.KAPPA.N24)-, DISODIUM, (SP-4-2)-

Systematic Name

English

HEMATOPORPHYRINMERCURY DISODIUM SALT

Common Name

English

Code System Code Type Description

FDA UNII

3937ZYJ7S1