CAS 314-13-6|tetrasodium 4-amino-6-[2-(4-{4-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate|EVANS B...

基本信息

化学结构

分子式

C₃₄H₂₄N₆Na₄O₁₄S₄

分子量

960.80524

精确质量

959.9824106

电荷

InChI

InChI=1S/C34H28N6O14S4.4Na/c1-15-11-17(3-7-21(15)37-39-23-9-5-19-25(55(43,44)45)13-27(57(49,50)51)31(35)29(19)33(23)41)18-4-8-22(16(2)12-18)38-40-24-10-6-20-26(56(46,47)48)14-28(58(52,53)54)32(36)30(20)34(24)42;;;;/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4

InChIKey

ATNOAWAQFYGAOY-UHFFFAOYSA-J

Canonic Smiles

Cc1cc(ccc1N=Nc1ccc2c(c1O)c(N)c(cc2S(=O)(=O)[O-])S(=O)(=O)[O-])c1ccc(c(c1)C)N=Nc1ccc2c(c1O)c(N)c(cc2S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric Smiles

[Na+].[Na+].[Na+].[Na+].Cc1c(ccc(c1)c1cc(C)c(cc1)/N=N/c1c(O)c2c(N)c(cc(c2cc1)S(=O)(=O)[O-])S(=O)(=O)[O-])/N=N/c1c(O)c2c(N)c(cc(c2cc1)S(=O)(=O)[O-])S(=O)(=O)[O-]

计算属性

JChem

LogD (pH = 7.4)

-3.61

LogD (pH = 5.5)

-3.61

Log P

-2.69

可自由旋转的化学键

质子供体

质子受体

里宾斯基五规则

false

Acid pKa

-3.24

极化表面积

370.74

极化性

85.08

摩尔折射率

214.18

LOG S

-6.71

数据来源

名称和标识

别名

EVANS BLUEDirect Blue 53C.I. 23860Evans Blue伊文思蓝direct blue 53C.I. Direct Blue 53C.I. 238604,4'-Bis(7-(1-amino-8-hydroxy-2,4-disulpho)naphthylazo)-3,3'-bitolyl, tetrasodium saltEvans blue4,4'-Bis(7-(1-amino-8-hydroxy-2,4-disulfo)naphthylazo)-3,3'-bitolyl, tetrasodium saltazovan blue4,4'-Bis(1-amino-8-hydroxy-2,4-disulpho-7-naphthylazo)-3,3'-bitolyl, tetrasodium salt4,4'-Bis(1-amino-8-hydroxy-2,4-disulfo-7-naphthylazo)-3,3'-bitolyl, tetrasodium saltC.I. direct blue 53 tetrasodium salt

IUPAC标准名

tetrasodium 4-amino-6-[2-(4-{4-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate tetrasodium 4-amino-6-[(E)-2-(4-{4-[(E)-2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate tetrasodium 4-amino-6-(2-{4'-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}diazen-1-yl)-5-hydroxynaphthalene-1,3-disulfonate

IUPAC传统名

tetrapotassium 4-amino-6-[2-(4-{4-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate tetrasodium 4-amino-6-[2-(4-{4-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate tetrasodium 4-amino-6-[(E)-2-(4-{4-[(E)-2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3-methylphenyl}-2-methylphenyl)diazen-1-yl]-5-hydroxynaphthalene-1,3-disulfonate tetrasodium 4-amino-6-(2-{4'-[2-(8-amino-1-hydroxy-5,7-disulfonatonaphthalen-2-yl)diazen-1-yl]-3,3'-dimethyl-[1,1'-biphenyl]-4-yl}diazen-1-yl)-5-hydroxynaphthalene-1,3-disulfonate

名称和标识

数据登录号

EC号

206-242-5

CAS号

314-13-6

MDL号

MFCD00004021

PubChem SID

248944561620913192485239424869872223448108

Color Index Number

23860

PubChem CID

95660579409

默克索引号

143905

PubMed文献链接

25459624255342342579416525754262254630292615038425791838256759962606632225810887260426232589005425524816261755782600354425878590

BRENDA数据库

2.5.1.18

BRENDA Ligand数据库

112046

KEGG ID

C19422

CHEBI ID

CHEBI:87630CHEBI:82467

维基百科标题

BKMS React数据库

Reaxys Registry

MetaboLights数据库

数据登录号

化合物性质

产品相关信息

质检报告

下载链接

纯度

Dye Content ~85%

主要成分

Dye content, ≥75%

Dye content, 85%

Empirical Formula (Hill Notation)

C34H24N6Na4O14S4

级别

for microscopy (Med., Vit.)

药理学性质

human ... PTPN1(5770), PTPRF(5792)

理化性质

λmax 611 nm

化合物性质

分子相关蛋白质

暂无数据

点击上传数据

分子图谱

暂无数据

点击上传数据

描述信息

MP Biomedicals

02151108

Dye content: ~85%
Reportedly used in double-labeling procedure for studying axonal branching.

Sigma Aldrich

E2129

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
包装
10, 50, 100 g in glass bottle

ChEBI

CHEBI:82467

An organic sodium salt that is the tetrasodium salt of 6,6'-{(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[diazene-2,1-diyl]}bis(4-amino-5-hydroxynaphthalene-1,3-disulfonate). It is sometimes used as a counterstain, especially in fluorescent methods to suppress background autofluorescence.

描述信息

参考文献

PubChem文献

数据源提供

• Science, 204: 873 (1979).

参考文献

生物活性

PubChem BioAssay

生物活性