Rose bengal I-125
HIT219158944
sdf文件结构编辑类似物检索
HIT ID: HIT219158944
Cas No: 742653-95-8
分子式: C20H4Cl4I4O5
分子量: 965.67
常用名: Rose bengal I-125
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4,5,6,7-tetrachloro-3',6'-dihydroxy-2',4',5',7'-tetra(125I)iodo-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
IUPAC: 4,5,6,7-tetrachloro-3',6'-dihydroxy-2',4',5',7'-tetra(125I)iodo-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
SMILES: Oc1c([125I])cc2c(Oc3c([125I])c(O)c([125I])cc3C22OC(=O)c3c2c(Cl)c(Cl)c(Cl)c3Cl)c1[125I]
SMILES: Oc1c([125I])cc2c(Oc3c([125I])c(O)c([125I])cc3C22OC(=O)c3c2c(Cl)c(Cl)c(Cl)c3Cl)c1[125I]
InChI key: IICCLYANAQEHCI-VUMIBXKJSA-N
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