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

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结构编辑

类似物检索

HIT ID:HIT219251293
Cas No:1279564-25-8
常用名:IRDye 800CW, Maleimide
IUPAC:trisodium 2-[2-(3-{2-[3,3-dimethyl-5-sulfonato-1-(4-sulfonatobutyl)-2,3-dihydro-1H-indol-2-ylidene]ethylidene}-2-(4-sulfonatophenoxy)cyclohex-1-en-1-yl)ethenyl]-1-(5-{[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]carbamoyl}pentyl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
IUPAC:trisodium 2-[2-(3-{2-[3,3-dimethyl-5-sulfonato-1-(4-sulfonatobutyl)-2,3-dihydro-1H-indol-2-ylidene]ethylidene}-2-(4-sulfonatophenoxy)cyclohex-1-en-1-yl)ethenyl]-1-(5-{[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]carbamoyl}pentyl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
InChI key:CAXPRNLNWICSJV-UHFFFAOYSA-K

分子式:C52H57N4Na3O16S4
分子量:1191.25
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+](CCCCCC(=O)NCCN4C(=O)C=CC4=O)c4ccc(cc4C3(C)C)S([O-])(=O)=O)=C2Oc2ccc(cc2)S([O-])(=O)=O)N(CCCCS([O-])(=O)=O)c2ccc(cc12)S([O-])(=O)=O
SMILES:[Na+].[Na+].[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCCC(=O)NCCN4C(=O)C=CC4=O)c4ccc(cc4C3(C)C)S([O-])(=O)=O)=C2Oc2ccc(cc2)S([O-])(=O)=O)N(CCCCS([O-])(=O)=O)c2ccc(cc12)S([O-])(=O)=O

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