HIT ID: HIT217585113
Cas No: 1798305-98-2
分子式: C37H49N5O13S2
分子量: 835.94
常用名: CalFluor 488 Azide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-[(2-{2-[4-azido-5-(2-{2-[dimethyl(3-sulfonatopropyl)azaniumyl]ethoxy}ethoxy)-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)phenoxy]ethoxy}ethyl)dimethylazaniumyl]propane-1-sulfonate
IUPAC: 3-[(2-{2-[4-azido-5-(2-{2-[dimethyl(3-sulfonatopropyl)azaniumyl]ethoxy}ethoxy)-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)phenoxy]ethoxy}ethyl)dimethylazaniumyl]propane-1-sulfonate
SMILES: C[N+](C)(CCCS([O-])(=O)=O)CCOCCOc1cc(OCCOCC[N+](C)(C)CCCS([O-])(=O)=O)c(cc1N=[N+]=[N-])-c1c2ccc(O)cc2oc2cc(=O)ccc12
SMILES: C[N+](C)(CCCS([O-])(=O)=O)CCOCCOc1cc(OCCOCC[N+](C)(C)CCCS([O-])(=O)=O)c(cc1N=[N+]=[N-])-c1c2ccc(O)cc2oc2cc(=O)ccc12
InChI key: SBSDHAKNPDGNRX-UHFFFAOYSA-N
