Omadacycline
HIT212658557
sdf文件结构编辑类似物检索
HIT ID: HIT212658557
Cas No: 389139-89-3
分子式: C29H40N4O7
分子量: 556.66
常用名: Omadacycline
氢键受体数 (HBA): 10
氢键供体数 (HBD): 6
LogP: -2.1811814
IUPAC: (4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-9-{[(2,2-dimethylpropyl)amino]methyl}-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
IUPAC: (4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-9-{[(2,2-dimethylpropyl)amino]methyl}-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
SMILES: CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(CNCC(C)(C)C)c(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)N(C)C |c:37,t:26|
SMILES: CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(CNCC(C)(C)C)c(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)N(C)C |c:37,t:26|
InChI key: JEECQCWWSTZDCK-IQZGDKDPSA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
4481-3天 购物车
Mcule
SC
6194-5周 购物车
Mcule
SC
12434-5周 购物车
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