Name: Cy5-ALN
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218847779
Cas No:1629601-00-8
常用名:Cy5-ALN
别名:Alendronate-Cy5
IUPAC:tetrasodium 2-[(1E,3E)-5-[(2E)-1-{5-[(4-hydrogen phosphonato-4-hydroxy-4-phosphonatobutyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
IUPAC:tetrasodium 2-[(1E,3E)-5-[(2E)-1-{5-[(4-hydrogen phosphonato-4-hydroxy-4-phosphonatobutyl)carbamoyl]pentyl}-3,3-dimethyl-5-sulfonato-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate
InChI key:JBMWQJCZZHRUJN-UHFFFAOYSA-J

分子式:C36H45N3Na4O14P2S2
分子量:961.79
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[Na+].[Na+].[Na+].[Na+].C[N+]1=C(\C=C\C=C\C=C2\N(CCCCCC(=O)NCCCC(O)(P(O)([O-])=O)P([O-])([O-])=O)c3ccc(cc3C2(C)C)S([O-])(=O)=O)C(C)(C)c2cc(ccc12)S([O-])(=O)=O
SMILES:[Na+].[Na+].[Na+].[Na+].C[N+]1=C(\C=C\C=C\C=C2\N(CCCCCC(=O)NCCCC(O)(P(O)([O-])=O)P([O-])([O-])=O)c3ccc(cc3C2(C)C)S([O-])(=O)=O)C(C)(C)c2cc(ccc12)S([O-])(=O)=O

Cy5-ALN (Alendronate-Cy5) functions as a bisphosphonate probe that is tagged with a fluorescent label [1].

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