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Miglustat hydrochloride

CAT: 0013-GTR19154681-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19154681-01Size:10 mg
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Description
Miglustat hydrochloride
CAS Number
72599-27-0
Product Name Alternative
NB-DNJ
Purity
> 98%
Form
Lyophilized
Smiles
CCCCN1C[C@@H] ([C@H] ([C@@H] ([C@H]1CO) O) O) O
Molecular Formula
C10H21NO4.HCl
Molecular Weight
255.74
Storage Conditions
Store lyophilized at -20oC, keep desiccated. In lyophilized form, the chemical is stable for 36 months. In solution, store at -20oC and use within 3 months to prevent loss of potency. Aliquot to avoid multiple freeze/thaw cycles.
Notes
For research use only.

Chemical Information

Miglustat

Miglustat is a hydroxypiperidine that is deoxynojirimycin in which the amino hydrogen is replaced by a butyl group. It has a role as an EC 2.4.1.80 (ceramide glucosyltransferase) inhibitor and an anti-HIV agent. It is a member of piperidines and a tertiary amino compound. It is functionally related to a duvoglustat.

CAS Number72599-27-0
PubChem CID51634
IUPAC Name(2R,3R,4R,5S)-1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol
Molecular FormulaC10H21NO4
Molecular Weight219.28
XLogP-0.6
Topological Polar Surface Area84.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity190
SMILES
CCCCN1C[C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O
InChI
InChI=1S/C10H21NO4/c1-2-3-4-11-5-8(13)10(15)9(14)7(11)6-12/h7-10,12-15H,2-6H2,1H3/t7-,8+,9-,10-/m1/s1
InChIKey
UQRORFVVSGFNRO-UTINFBMNSA-N
Chemical Structure
2D Structure
2D structure of Miglustat
CAS: 72599-27-0
CID: 51634
Formula: C10H21NO4
MW: 219.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight219.28
XLogP3-0.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass219.14705815
Monoisotopic Mass219.14705815
Topological Polar Surface Area84.2 Ų
Heavy Atom Count15
Formal Charge0
Complexity190
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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