Sucrose acetoisobutyrate
HIT217607200
sdf文件结构编辑类似物检索
HIT ID: HIT217607200
Cas No: 126-13-6
分子式: C40H62O19
分子量: 846.917
常用名: Sucrose acetoisobutyrate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: [(2S,3S,4R,5R)-5-[(acetyloxy)methyl]-2-{[(2R,3R,4S,5R,6R)-6-[(acetyloxy)methyl]-3,4,5-tris[(2-methylpropanoyl)oxy]oxan-2-yl]oxy}-3,4-bis[(2-methylpropanoyl)oxy]oxolan-2-yl]methyl 2-methylpropanoate
IUPAC: [(2S,3S,4R,5R)-5-[(acetyloxy)methyl]-2-{[(2R,3R,4S,5R,6R)-6-[(acetyloxy)methyl]-3,4,5-tris[(2-methylpropanoyl)oxy]oxan-2-yl]oxy}-3,4-bis[(2-methylpropanoyl)oxy]oxolan-2-yl]methyl 2-methylpropanoate
SMILES: CC(C)C(=O)OC[C@@]1(O[C@H]2O[C@H](COC(C)=O)[C@@H](OC(=O)C(C)C)[C@H](OC(=O)C(C)C)[C@H]2OC(=O)C(C)C)O[C@H](COC(C)=O)[C@@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C
SMILES: CC(C)C(=O)OC[C@@]1(O[C@H]2O[C@H](COC(C)=O)[C@@H](OC(=O)C(C)C)[C@H](OC(=O)C(C)C)[C@H]2OC(=O)C(C)C)O[C@H](COC(C)=O)[C@@H](OC(=O)C(C)C)[C@@H]1OC(=O)C(C)C
InChI key: ZNEBZIJCDDCNRC-SWTLDUCYSA-N
共显示2个结果
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TargetMol
SC
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Mcule
SC
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