Name: Alcian blue
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212714576
Cas No:12040-44-7
常用名:Alcian blue
IUPAC:copper(2+) 6,15,25,33-tetrakis({[(dimethylamino)(dimethyliminiumyl)methyl]sulfanyl}methyl)-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1^{3,10}.1^{12,19}.1^{21,28}.0^{4,9}.0^{13,18}.0^{22,27}.0^{31,36}]tetraconta-2,4(9),5,7,10(40),11,13,15,17,19,21(38),22(27),23,25,28,31(36),32,34-octadecaene-37,39-diide tetrachloride
IUPAC:copper(2+) 6,15,25,33-tetrakis({[(dimethylamino)(dimethyliminiumyl)methyl]sulfanyl}methyl)-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1^{3,10}.1^{12,19}.1^{21,28}.0^{4,9}.0^{13,18}.0^{22,27}.0^{31,36}]tetraconta-2,4(9),5,7,10(40),11,13,15,17,19,21(38),22(27),23,25,28,31(36),32,34-octadecaene-37,39-diide tetrachloride
InChI key:OBSNQDWGQFWBKH-UHFFFAOYSA-J

分子式:C56H70Cl4CuN16S4
分子量:1300.87
氢键供体数 (HBD):0
氢键受体数 (HBA):12
LogP:-5.968381
SMILES:[Cl-].[Cl-].[Cl-].[Cl-].[Cu++].[#6]-[#7](-[#6])-[#6](\[#16]-[#6]-c1ccc2-[#6]-3-[#7-]-[#6](-[#7]=[#6]-4-[#7]=[#6](-[#7]=c5[n-]c(=[#7]-[#6]-6=[#7]-[#6](=[#7]-3)-c3cc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](\[#6])-[#6])ccc-63)c3cc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](\[#6])-[#6])ccc53)-c3ccc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](/[#6])-[#6])cc-43)-c2c1)=[#7+](/[#6])-[#6] |t:15,22|
SMILES:[Cl-].[Cl-].[Cl-].[Cl-].[Cu++].[#6]-[#7](-[#6])-[#6](\[#16]-[#6]-c1ccc2-[#6]-3-[#7-]-[#6](-[#7]=[#6]-4-[#7]=[#6](-[#7]=c5[n-]c(=[#7]-[#6]-6=[#7]-[#6](=[#7]-3)-c3cc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](\[#6])-[#6])ccc-63)c3cc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](\[#6])-[#6])ccc53)-c3ccc(-[#6]-[#16]\[#6](-[#7](-[#6])-[#6])=[#7+](/[#6])-[#6])cc-43)-c2c1)=[#7+](/[#6])-[#6] |t:15,22|

Alcian blue is a copper-containing dye used as a gelling agent for lubricants, for staining of bacteria and for the dyeing of histiocytes and fibroblasts in vivo.

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