SM-337
HIT212718287
sdf文件结构编辑类似物检索
HIT ID: HIT212718287
Cas No: 1071992-61-4
分子式: C35H41N5O4
分子量: 595.744
常用名: SM-337
氢键受体数 (HBA): 5
氢键供体数 (HBD): 3
LogP: 2.650216
IUPAC: (5S,8S,10aR)-N-(diphenylmethyl)-5-[(2S)-2-(methylamino)propanamido]-6-oxo-3-(2-phenylacetyl)-decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide
IUPAC: (5S,8S,10aR)-N-(diphenylmethyl)-5-[(2S)-2-(methylamino)propanamido]-6-oxo-3-(2-phenylacetyl)-decahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide
SMILES: [H][C@]12CC[C@H](N1C(=O)[C@H](CN(CC2)C(=O)Cc1ccccc1)NC(=O)[C@H](C)NC)C(=O)NC(c1ccccc1)c1ccccc1
SMILES: [H][C@]12CC[C@H](N1C(=O)[C@H](CN(CC2)C(=O)Cc1ccccc1)NC(=O)[C@H](C)NC)C(=O)NC(c1ccccc1)c1ccccc1
InChI key: YBYZHVZWINISJO-XPSCAIQQSA-N
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