Janelia Fluor® 646, SE
HIT214322810
sdf文件结构编辑类似物检索
HIT ID: HIT214322810
Cas No: 1811539-59-9
分子式: C33H31N3O6Si
分子量: 593.711
常用名: Janelia Fluor® 646, SE
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 1-[13-(azetidin-1-yl)-9-(2-carboxylato-5-{[(2,5-dioxopyrrolidin-1-yl)oxy]carbonyl}phenyl)-2,2-dimethyl-2-silatricyclo[8.4.0.0^{3,8}]tetradeca-1(14),3,6,8,10,12-hexaen-5-ylidene]-1lambda5-azetidin-1-ylium
IUPAC: 1-[13-(azetidin-1-yl)-9-(2-carboxylato-5-{[(2,5-dioxopyrrolidin-1-yl)oxy]carbonyl}phenyl)-2,2-dimethyl-2-silatricyclo[8.4.0.0^{3,8}]tetradeca-1(14),3,6,8,10,12-hexaen-5-ylidene]-1lambda5-azetidin-1-ylium
SMILES: [#6][Si]1([#6])[#6]-2=[#6]\[#6](-[#6]=[#6]-[#6]-2=[#6](-c2cc(ccc2-[#6](-[#8-])=O)-[#6](=O)-[#8]-[#7]-2-[#6](=O)-[#6]-[#6]-[#6]-2=O)-c2ccc(cc12)-[#7]-1-[#6]-[#6]-[#6]-1)=[#7+]-1/[#6]-[#6]-[#6]-1 |c:6,t:3,9|
SMILES: [#6][Si]1([#6])[#6]-2=[#6]\[#6](-[#6]=[#6]-[#6]-2=[#6](-c2cc(ccc2-[#6](-[#8-])=O)-[#6](=O)-[#8]-[#7]-2-[#6](=O)-[#6]-[#6]-[#6]-2=O)-c2ccc(cc12)-[#7]-1-[#6]-[#6]-[#6]-1)=[#7+]-1/[#6]-[#6]-[#6]-1 |c:6,t:3,9|
InChI key: ODBCGJUBBYOJOS-UHFFFAOYSA-N
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