O-6-O-Phosphono-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->2)-D-mannose
基本情報
- CAS
72672-17-4- 標準SMILES
O=C[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@H]4O[C@H](COP(=O)(O)O)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3O)[C@@H]2O)[C@@H]1O)[C@@H](O)[C@H](O)[C@H](O)CO- InChIKey
LEZPPJZANYGKGD-ABCYLNNDSA-N- 分子式
- C30H53O29P
- 平均分子量
- 908.7 g/mol
- 単同位体質量
- 908.24101265
概要
ligand for mannose 6-phosphate receptor
名称と識別子
- 優先名称
- O-6-O-Phosphono-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->2)-D-mannose
- IUPAC
- [(2R,3S,4S,5S,6R)-6-[(2R,3S,4S,5R,6R)-2-[(2R,3S,4S,5R,6R)-2-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(2S,3S,4R,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]oxyoxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl dihydrogen phosphate
名称と別名
Pentamannose phosphate72672-17-4RefChem:928030DTXCID10145476O-6-O-Phosphono-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->3)-O-alpha-D-mannopyranosyl-(1->2)-D-mannoseDTXSID80222985O-6-O-Phosphono-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-2)-D-mannoseD-Mannose, O-6-O-phosphono-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-3)-O-alpha-D-mannopyranosyl-(1-2)-
データベース識別子
- CAS
72672-17-4- PubChem CID
- 9876193
物性
構造計算による物性
- XLogP
- -11.5
- 極性表面積
- 481 Ų
- 水素結合供与体数
- 18
- 水素結合受容体数
- 29
- 回転可能結合数
- 19
- 重原子数
- 60
- 形式電荷
- 0
- 複雑度
- 1,360
関連反応
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