1-Deoxymannojirimycin
Grundinformationen
- CAS
84444-90-6- Standard-SMILES
OC[C@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O- InChIKey
LXBIFEVIBLOUGU-KVTDHHQDSA-N- Summenformel
- C6H13NO4
- Durchschnittliche Molmasse
- 163,17 g/mol
- Monoisotopische Masse
- 163,0844579
Überblick
1-deoxymannojirimycin has been reported in Adenophora triphylla var. japonica, Omphalea diandra, and other organisms with data available.
Namen und Bezeichner
- Bevorzugter Name
- 1-Deoxymannojirimycin
- IUPAC
- (2R,3R,4R,5R)-2-(hydroxymethyl)piperidine-3,4,5-triol
- Englischer Name
- DEOXYMANNOJIRIMYCIN
- Summenformel
- C6H13NO4
- Molmasse
- 163.17
Namen und Synonyme
1-Deoxymannojirimycin84444-90-61 DeoxymannojirimycinRefChem:432067Deoxymannojirimycin(2R,3R,4R,5R)-2-(hydroxymethyl)piperidine-3,4,5-triol1hxkD-manno-Deoxynojirimycindeoxymannojirimycin hydrochlorideCHEMBL848441,5-DIDEOXY-1,5-IMINO-D-MANNITOLDeoxymannojirimycin HCl
Weitere Namen anzeigen
LU-1Antibiotic LU-11,5-Dideoxy-1,5-epimino-D-mannitolDeoxymannojirimycin, D-manno-Deoxynojirimycin(2R,3R,4R,5R)-2-methylolpiperidine-3,4,5-triol
DMJ(2R,3R,4R,5R)-2-(Hydroxymethyl)-3,4,5-piperidinetriolLU 184444-90-6-deleted nameOx5D-DeoxymannojirimycinNSC6251091fo2
Datenbank-Bezeichner
- CAS
84444-90-6- PubChem CID
- 72258
- ChEMBL
CHEMBL84844- Nikkaji
- J227.975D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -2,3
- Polarare Oberfläche (TPSA)
- 93 Ų
- H-Brücken-Donoren
- 5
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 132
Experimentelle und physikochemische Eigenschaften
DrugsPharmaceuticals -> Antibiotics
Physikochemische Eigenschaften
- Schmelzpunkt
- 164 · 164-167 °C
- Siedepunkt
- 361.1 · 361.1±42.0 °C(Predicted)
- Dichte
- 1.456 · 1.456±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- 1 mg/mLwater: · ethanol: 1mg/mLwater: 1mg/mL
- pka
- 13.77 · 13.77±0.70(Predicted)
- Aggregatzustand
- crystalline solid
- Farbe
- white
- InChI
- 1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4-,5-,6-/m1/s1
- InChIKey
- LXBIFEVIBLOUGU-KVTDHHQDSA-N
Sicherheit und Regulatorisches
Gefahrenhinweise
Regulatory Information3,4,5-Piperidinetriol, 2-(hydroxymethyl)-, (2R,3R,4R,5R)-: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- wgk
- 3
- risk_code
- 20/21/22
- hazard_code
- Xn
- safety_code
- 36
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly.
Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
Anwendungen
Verwendencompetitive inhibitor of glucosidase I and II; pig kidney trehalase inhibitor
Anbieter13 Anbieter
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
杭州璟皓生物科技有限公司（原河南辛迪加生物）17513242016 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
BOC Sciences[email protected]
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