基本情報
- CAS
30142-85-9- 標準SMILES
O=C[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO- InChIKey
GZCGUPFRVQAUEE-KVTDHHQDSA-N- 分子式
- C6H12O6
- 平均分子量
- 180.16 g/mol
概要
Aldehydo-D-mannose is the D-enantiomer of aldehydo-mannose. It is a D-mannose and an aldehydo-mannose. It is an enantiomer of an aldehydo-L-mannose.
名称と識別子
- 優先名称
- Demannose
- IUPAC
- (2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal
- 英語名
- polymannose
- 分子式
- C6H12O6
- 分子量
- 180.15588
名称と別名
(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanalDemannosePHA4727WTPCERC-802GlyTouCan:G95531HXRefChem:1083138G95531HX3458-28-4DL-Mannosealdehydo-D-mannose31103-86-3aldehydo-D-manno-hexose
名称をさらに表示
polymannose
Mannose, D-30142-85-9MFCD00799233D-Mannose - F287100-74-7UNII-PHA4727WTPDemanosaNSC26247
データベース識別子
- CAS
30142-85-9、31103-86-3、3458-28-4- PubChem CID
- 161658
- DTXSID
DTXSID5040463- ChEMBL
CHEMBL1232295- ChEBI
CHEBI:37675- UNII
- PHA4727WTP
- EC Number
- 222-392-4
- Nikkaji
- J82.111J
物性
構造計算による物性
- XLogP
- -2.9
- 極性表面積
- 118 Ų
- 水素結合供与体数
- 5
- 水素結合受容体数
- 6
- 回転可能結合数
- 5
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 138
実験および物理化学的性質
Chemical ClassesBiological Agents -> Monosaccharides and Derivatives
SpringerMaterials PropertiesCrystal structure
Vapor Pressure0.00000002 [mmHg]
Physical DescriptionWhite hygroscopic powder; [Alfa Aesar MSDS]
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 99.4% (158 of 159) of all reports.
Not Classified
Aggregated GHS information provided per 159 reports by companies from 3 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Chemical: D-Mannose
Status: Active Update: 15-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23819
D-Mannose: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - D-Mannose: Human health tier I assessment
Hazards SummaryMay cause irritation; [Alfa Aesar MSDS]
Hazard Classes and CategoriesNot Classified
化学と産業
用途と製造
UsesIsomer of glucose; [ChemIDplus]
General Manufacturing InformationD-Mannose: ACTIVE
関連反応
68 件
化合物ノート
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