Name: D-(+)-Cellotetraose tetradecaacetate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214484704
Cas No:83058-25-7
常用名:D-(+)-Cellotetraose tetradecaacetate
常用名:D-(+)-Cellotetraose tetradecaacetate
别名:纤维四糖十四乙酸酯
IUPAC:[(2R,3R,4S,5R,6S)-4,5-bis(acetyloxy)-3-{[(2S,3R,4S,5R,6R)-3,4-bis(acetyloxy)-6-[(acetyloxy)methyl]-5-{[(2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]oxy}-6-{[(2R,3R,4S,5R)-4,5,6-tris(acetyloxy)-2-[(acetyloxy)methyl]oxan-3-yl]oxy}oxan-2-yl]methyl acetate
IUPAC:[(2R,3R,4S,5R,6S)-4,5-bis(acetyloxy)-3-{[(2S,3R,4S,5R,6R)-3,4-bis(acetyloxy)-6-[(acetyloxy)methyl]-5-{[(2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]oxy}-6-{[(2R,3R,4S,5R)-4,5,6-tris(acetyloxy)-2-[(acetyloxy)methyl]oxan-3-yl]oxy}oxan-2-yl]methyl acetate
InChI key:NKUTUOSZFVYRTC-NZEQKUHWSA-N

分子式:C52H70O35
分子量:1255.097
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](COC(C)=O)OC(OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1O[C@@H]1O[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]2OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O
SMILES:CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](COC(C)=O)OC(OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1O[C@@H]1O[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]2OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

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