ΔDi6S
HIT218849180
sdf文件结构编辑类似物检索
HIT ID: HIT218849180
Cas No: 51449-08-2
分子式: C14H21NO14S
分子量: 459.38
常用名: ΔDi6S
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R,3R,4S)-2-{[(2R,3R,4S,5R)-2-acetamido-4,5-dihydroxy-1-oxo-6-(sulfooxy)hexan-3-yl]oxy}-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid
IUPAC: (2R,3R,4S)-2-{[(2R,3R,4S,5R)-2-acetamido-4,5-dihydroxy-1-oxo-6-(sulfooxy)hexan-3-yl]oxy}-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid
SMILES: CC(=O)N[C@@H](C=O)[C@@H](O[C@@H]1OC(=C[C@H](O)[C@H]1O)C(O)=O)[C@@H](O)[C@H](O)COS(O)(=O)=O
SMILES: CC(=O)N[C@@H](C=O)[C@@H](O[C@@H]1OC(=C[C@H](O)[C@H]1O)C(O)=O)[C@@H](O)[C@H](O)COS(O)(=O)=O
InChI key: AWPDIFXYBYYGRI-WIHAIFTMSA-N
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