Name: IRDye 800CW, DBCO
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT219251307
Cas No:1373928-39-2
常用名:IRDye 800CW, DBCO
IUPAC:trisodium 2-(2-{3-[2-(1-{5-[(3-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl}-3-oxopropyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)ethylidene]-2-(4-sulfonatophenoxy)cyclohex-1-en-1-yl}ethenyl)-3,3-dimethyl-1-(4-sulfonatobutyl)-3H-indol-1-ium-5-sulfonate
IUPAC:trisodium 2-(2-{3-[2-(1-{5-[(3-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl}-3-oxopropyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene)ethylidene]-2-(4-sulfonatophenoxy)cyclohex-1-en-1-yl}ethenyl)-3,3-dimethyl-1-(4-sulfonatobutyl)-3H-indol-1-ium-5-sulfonate
InChI key:PLZNLSRDJOEMNQ-UHFFFAOYSA-K

分子式:C64H65N4Na3O15S4
分子量:1327.45
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[Na+].[Na+].[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCS([O-])(=O)=O)c4ccc(cc4C3(C)C)S([O-])(=O)=O)=C2Oc2ccc(cc2)S([O-])(=O)=O)N(CCCCCC(=O)NCCC(=O)N2Cc3ccccc3C#Cc3ccccc23)c2ccc(cc12)S([O-])(=O)=O
SMILES:[Na+].[Na+].[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCS([O-])(=O)=O)c4ccc(cc4C3(C)C)S([O-])(=O)=O)=C2Oc2ccc(cc2)S([O-])(=O)=O)N(CCCCCC(=O)NCCC(=O)N2Cc3ccccc3C#Cc3ccccc23)c2ccc(cc12)S([O-])(=O)=O

IRDye 800CW, DBCO是一种近红外（NIR）荧光染料，配有用于结合的DBCO反应基团。DBCO反应基团可以通过无铜点击化学反应与叠氮化合物或生物分子进行反应。

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