Name: Chitotetraose Tetradecaacetate
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219586346
Cas No:117399-51-6
常用名:Chitotetraose Tetradecaacetate
别名:壳四糖十四乙酸酯
IUPAC:[(2R,3S,4R,5R,6S)-4-(acetyloxy)-3-{[(2S,3R,4R,5S,6R)-4-(acetyloxy)-6-[(acetyloxy)methyl]-5-{[(2S,3R,4R,5S,6R)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}-3-acetamidooxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6S)-4,6-bis(acetyloxy)-2-[(acetyloxy)methyl]-5-acetamidooxan-3-yl]oxy}-5-acetamidooxan-2-yl]methyl acetate
IUPAC:[(2R,3S,4R,5R,6S)-4-(acetyloxy)-3-{[(2S,3R,4R,5S,6R)-4-(acetyloxy)-6-[(acetyloxy)methyl]-5-{[(2S,3R,4R,5S,6R)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}-3-acetamidooxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6S)-4,6-bis(acetyloxy)-2-[(acetyloxy)methyl]-5-acetamidooxan-3-yl]oxy}-5-acetamidooxan-2-yl]methyl acetate
InChI key:OYGWXILTVZPHON-KEMNZMDTSA-N

分子式:C52H74N4O31
分子量:1251.161
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(=O)N[C@H]1[C@H](O[C@@H]2[C@@H](COC(C)=O)O[C@@H](O[C@@H]3[C@@H](COC(C)=O)O[C@@H](OC(C)=O)[C@H](NC(C)=O)[C@H]3OC(C)=O)[C@H](NC(C)=O)[C@H]2OC(C)=O)O[C@H](COC(C)=O)[C@@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2NC(C)=O)[C@@H]1OC(C)=O
SMILES:CC(=O)N[C@H]1[C@H](O[C@@H]2[C@@H](COC(C)=O)O[C@@H](O[C@@H]3[C@@H](COC(C)=O)O[C@@H](OC(C)=O)[C@H](NC(C)=O)[C@H]3OC(C)=O)[C@H](NC(C)=O)[C@H]2OC(C)=O)O[C@H](COC(C)=O)[C@@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2NC(C)=O)[C@@H]1OC(C)=O

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