8-Br-GTP
HIT214323322
sdf文件结构编辑类似物检索
HIT ID: HIT214323322
Cas No: 23197-98-0
分子式: C10H15BrN5O14P3
分子量: 602.076
常用名: 8-Br-GTP
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: ({[({[(2R,3S,4R,5R)-5-(2-amino-8-bromo-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
IUPAC: ({[({[(2R,3S,4R,5R)-5-(2-amino-8-bromo-6-oxo-6,9-dihydro-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
SMILES: Nc1nc(=O)c2nc(Br)n([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2[nH]1
SMILES: Nc1nc(=O)c2nc(Br)n([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]3O)c2[nH]1
InChI key: CNYUHYBBHQMZQJ-UMMCILCDSA-N
共显示1个结果
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