Deflazacort
HIT101393053
sdf文件结构编辑类似物检索
HIT ID: HIT101393053
Cas No: 14484-47-0
分子式: C25H31NO6
分子量: 441.524
常用名: Deflazacort
氢键受体数 (HBA): 6
氢键供体数 (HBD): 1
LogP: 2.860000000000000e+000
IUPAC: 2-[(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-6,14,17-trien-8-yl]-2-oxoethyl acetate
IUPAC: 2-[(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-6,14,17-trien-8-yl]-2-oxoethyl acetate
SMILES: CC(=O)OCC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]21C |c:23,t:8,19|
SMILES: CC(=O)OCC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]21C |c:23,t:8,19|
InChI key: FBHSPRKOSMHSIF-GRMWVWQJSA-N
共显示2个结果
供应商规格单价货期纯度操作
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