Wybutosine
HIT219586595
sdf文件结构编辑类似物检索
HIT ID: HIT219586595
Cas No: 55196-46-8
分子式: C21H28N6O9
分子量: 508.488
常用名: Wybutosine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl (2S)-4-{3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxo-3H,4H,9H-imidazo[1,2-a]purin-7-yl}-2-[(methoxycarbonyl)amino]butanoate
IUPAC: methyl (2S)-4-{3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxo-3H,4H,9H-imidazo[1,2-a]purin-7-yl}-2-[(methoxycarbonyl)amino]butanoate
SMILES: [H][C@]1(O[C@H](CO)[C@@H](O)[C@H]1O)n1cnc2c1n(C)c1nc(C)c(CC[C@H](NC(=O)OC)C(=O)OC)n1c2=O
SMILES: [H][C@]1(O[C@H](CO)[C@@H](O)[C@H]1O)n1cnc2c1n(C)c1nc(C)c(CC[C@H](NC(=O)OC)C(=O)OC)n1c2=O
InChI key: QAOHCFGKCWTBGC-QHOAOGIMSA-N
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