Grundinformationen
- Standard-SMILES
OC[C@H]1N[C@H](CO)[C@@H](O)C(O)[C@H]1O- InChIKey
CLVUFWXGNIFGNC-QTSLKERKSA-N- Summenformel
- C7H15NO5
- Durchschnittliche Molmasse
- 193,2 g/mol
- Monoisotopische Masse
- 193,09502258
Überblick
2,6-Bis(hydroxymethyl)piperidine-3,4,5-triol has been reported in Omphalea diandra, Lonchocarpus heptaphyllus, and other organisms with data available.
Namen und Bezeichner
- Bevorzugter Name
- (2r,3r,5s,6r)-2,6-Bis(hydroxymethyl)piperidine-3,4,5-triol
- IUPAC
- (2R,3S,5R,6R)-2,6-bis(hydroxymethyl)piperidine-3,4,5-triol
- Englischer Name
- ALPHA-HOMONOJIRIMYCIN
- Summenformel
- C7H15NO5
- Molmasse
- 193.2
Namen und Synonyme
(2r,3r,5s,6r)-2,6-bis(hydroxymethyl)piperidine-3,4,5-triola-Homonojirimycin(2R,3S,5R,6R)-2,6-bis(hydroxymethyl)piperidine-3,4,5-triolRefChem:68882alpha-Homonojirimycin119557-99-2HomonojirimycinCHEMBL501355CHEMBL21116882,6-Bis-hydroxymethyl-piperidine-3,4,5-triolHnj cpdalpha-Homoallonojirimycin
Weitere Namen anzeigen
α-Homonojirimycinα-Homonojirimycin>ALPHA-HOMONOJIRIMYCIN(2R)-2α,6β-Bis(hydroxymethyl)piperidine-3α,4β,5α-triol(2R)-2α,6β-Bis(hydroxymethyl)-3α,4β,5α-piperidinetriol3,4,5-Piperidinetriol, 2,6-bis(hydroxymethyl)-, (2R,3R,5S,6R)-
-HomonojirimycinHomo-nojirimycinalpha-homonojirmycin2,6-bis(hydroxymethyl)piperidine-3,4,5-triol.alpha.-Homonojirimycin| cent-Homonojirimycin2,6-Dideoxy-2,6-epimino-D-glycero-L-gulo-heptitolorb1705470
Datenbank-Bezeichner
- CAS
119557-99-2- PubChem CID
- 159496
- DTXSID
DTXSID40923002- ChEMBL
CHEMBL2111688、CHEMBL501355- Nikkaji
- J1.195.947D、J265.070C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -2,4
- Polarare Oberfläche (TPSA)
- 113 Ų
- H-Brücken-Donoren
- 6
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 151
Physikochemische Eigenschaften
- Schmelzpunkt
- 207 °C · 207 °C
- Siedepunkt
- 432 · 432.0±45.0 °C(Predicted)
- Dichte
- 1.479 · 1.479±0.06 g/cm3(Predicted)
- Brechungsindex
- 84.5 ° · 84.5 ° (C=1, H2O)
- storage temp.
- Freezer
- pka
- 13.43 · 13.43±0.70(Predicted)
- Aggregatzustand
- powder to crystal
- Farbe
- White to Almost white
- CAS Datenbank
- 119557 · 119557-99-2
Sicherheit und Regulatorisches
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2940.00.6000
Chemie und Industrie
Anwendungen
Verwendenα-Homonojirimycin (HMJ) is used as an inhibitor of several carbohydrate degrading enzymes including α-glucosidases, glycoprotein processing enzyme glucosidase II and maltase.
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