基本情報
- CAS
89178-08-5- 標準SMILES
OC[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O[C@@H]3[C@@H](O[C@H]4[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O- InChIKey
NXPDEZAEUSDDQF-YCPSAUHXSA-N- 分子式
- C24H42O21
- 平均分子量
- 666.6 g/mol
- 単同位体質量
- 666.22185834
概要
Alpha-D-Manp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp is alpha-D-Manp-(13)-alpha-D-Manp-(12)-alpha-D-Manp-(12)-D-Manp having alpha-configuration at the reducing end anomeric centre.
名称と識別子
- 優先名称
- alpha-D-Manp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp
- IUPAC
- (2S,3S,4S,5S,6R)-3-[(2R,3S,4S,5S,6R)-3-[(2R,3S,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,4,5-triol
名称と別名
CHEBI:64166alpha-D-Manp-(1->3)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manpalpha-D-mannopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranoseRefChem:936450GlyTouCan:G29966LRG29966LRManalpha1->3Manalpha1->2Manalpha1->2Manalphaalpha-D-Man-(1->3)-alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Manalpha-D-mannosyl-(1->3)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->2)-alpha-D-mannoseEpitope ID:164175DTXSID20111498189178-08-5
名称をさらに表示
Q27133088O-I+/--D-Mannopyranosyl-(1a3)-O-I+/--D-mannopyranosyl-(1a2)-O-I+/--D-mannopyranosyl-(1a2)-I+/--D-mannopyranose
データベース識別子
- CAS
89178-08-5- PubChem CID
- 5459972
- DTXSID
DTXSID201114981- ChEBI
物性
構造計算による物性
- XLogP
- -7.4
- 極性表面積
- 348 Ų
- 水素結合供与体数
- 14
- 水素結合受容体数
- 21
- 回転可能結合数
- 10
- 重原子数
- 45
- 形式電荷
- 0
- 複雑度
- 918
関連反応
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