XYLENOL ORANGE TETRASODIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	C31H28N2O13S.4Na
Molecular Weight	760.584
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].CC1=CC(=CC(CN(CC([O-])=O)CC([O-])=O)=C1O)C2(OS(=O)(=O)C3=CC=CC=C23)C4=CC(CN(CC([O-])=O)CC([O-])=O)=C(O)C(C)=C4

InChI

InChIKey=YIIQUYHVWRJXEM-UHFFFAOYSA-J

InChI=1S/C31H32N2O13S.4Na/c1-17-7-21(9-19(29(17)42)11-32(13-25(34)35)14-26(36)37)31(23-5-3-4-6-24(23)47(44,45)46-31)22-8-18(2)30(43)20(10-22)12-33(15-27(38)39)16-28(40)41;;;;/h3-10,42-43H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41);;;;/q;4*+1/p-4

HIDE SMILES / InChI

Molecular Formula	C31H28N2O13S
Molecular Weight	668.625
Charge	-4
Count

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

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Approval Year

PubMed

Title	Date	PubMed
Potent inhibitors of human immunodeficiency virus type 1 integrase: identification of a novel four-point pharmacophore and tetracyclines as novel inhibitors.	1997 Dec	9415714

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 03:30:05 GMT 2023` Edited by `admin` on `Sat Dec 16 03:30:05 GMT 2023`
Record UNII	0549U815B1
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

XYLENOL ORANGE TETRASODIUM

Common Name

English

XYLENOL ORANGE TETRASODIUM SALT [MI]

Common Name

English

GLYCINE, N,N'-(3H-2,1-BENZOXATHIOL-3-YLIDENEBIS((6-HYDROXY-5-METHYL-3,1-PHENYLENE)METHYLENE))BIS(N-(CARBOXYMETHYL)-, S,S-DIOXIDE, TETRASODIUM SALT

Common Name

English

XYLENOL ORANGE TETRASODIUM SALT

Common Name

English

OMNIPUR-EDM

Common Name

English

ACETIC ACID, (3H-2,1-BENZOXATHIOL-3-YLIDENEBIS((6-HYDROXY-5-METHYL-M-PHENYLENE)METHYLENENITRILO))TETRA-, S,S-DIOXIDE, TETRASODIUM SALT

Common Name

English

XYLENOL ORANGE, TETRASODIUM SALT

Common Name

English

GLYCINE, N,N'-((1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS((6-HYDROXY-5-METHYL-3,1-PHENYLENE)METHYLENE))BIS(N-(CARBOXYMETHYL)-, TETRASODIUM SALT

Common Name

English

XYLENE ORANGE TETRASODIUM SALT

Common Name

English

O-CRESOLPHTHALEXON-S TETRASODIUM SALT

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID80889471