DiSulfo-Cy5 alkyne
HIT217585086
sdf文件结构编辑类似物检索
HIT ID: HIT217585086
Cas No: 1617497-19-4
分子式: C35H40N3NaO7S2
分子量: 701.83
常用名: DiSulfo-Cy5 alkyne
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: sodium 2-[5-(3,3-dimethyl-1-{5-[(prop-2-yn-1-yl)carbamoyl]pentyl}-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: sodium 2-[5-(3,3-dimethyl-1-{5-[(prop-2-yn-1-yl)carbamoyl]pentyl}-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
SMILES: [Na+].C[N+]1=C(C=CC=CC=C2N(CCCCCC(=O)NCC#C)c3ccc(cc3C2(C)C)S([O-])(=O)=O)C(C)(C)c2cc(ccc12)S([O-])(=O)=O
SMILES: [Na+].C[N+]1=C(C=CC=CC=C2N(CCCCCC(=O)NCC#C)c3ccc(cc3C2(C)C)S([O-])(=O)=O)C(C)(C)c2cc(ccc12)S([O-])(=O)=O
InChI key: FBFMHITXFHJTID-UHFFFAOYSA-M
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