Name: Oxaquin TEA
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT215519197
Cas No:
常用名:Oxaquin TEA
别名:Oxaquin TEA(790704-50-6 Free base), MCB-3837 TEA, DNV3837 TEA
别名:Oxaquin TEA(790704-50-6 Free base), MCB-3837 TEA, DNV3837 TEA
IUPAC:1-cyclopropyl-7-[4-({4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy}methyl)-4-(phosphonooxy)piperidin-1-yl]-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid; triethylamine
IUPAC:1-cyclopropyl-7-[4-({4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenoxy}methyl)-4-(phosphonooxy)piperidin-1-yl]-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid; triethylamine
InChI key:QMPNHMBQCLTWNP-BDQAORGHSA-N

分子式:C37H48F2N5O11P
分子量:807.786
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCN(CC)CC.CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(OCC2(CCN(CC2)c2cc3n(cc(C(O)=O)c(=O)c3cc2F)C2CC2)OP(O)(O)=O)c(F)c1
SMILES:CCN(CC)CC.CC(=O)NC[C@H]1CN(C(=O)O1)c1ccc(OCC2(CCN(CC2)c2cc3n(cc(C(O)=O)c(=O)c3cc2F)C2CC2)OP(O)(O)=O)c(F)c1

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