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α-Homonojirimycin

CAT: 0607-BA7766-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0607-BA7766-5Size:5 mg
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CAS Number
119557-99-2
Molecular Formula
C7H15NO5
Molecular Weight
193.20
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

(2r,3r,5s,6r)-2,6-Bis(hydroxymethyl)piperidine-3,4,5-triol

2,6-Bis(hydroxymethyl)piperidine-3,4,5-triol has been reported in Omphalea diandra, Lonchocarpus heptaphyllus, and other organisms with data available.

CAS Number119557-99-2
PubChem CID159496
IUPAC Name(2R,3S,5R,6R)-2,6-bis(hydroxymethyl)piperidine-3,4,5-triol
Molecular FormulaC7H15NO5
Molecular Weight193.20
XLogP-2.4
Topological Polar Surface Area113
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity151
SMILES
C([C@@H]1[C@H](C([C@H]([C@H](N1)CO)O)O)O)O
InChI
InChI=1S/C7H15NO5/c9-1-3-5(11)7(13)6(12)4(2-10)8-3/h3-13H,1-2H2/t3-,4-,5-,6+,7?/m1/s1
InChIKey
CLVUFWXGNIFGNC-QTSLKERKSA-N
Chemical Structure
2D Structure
2D structure of (2r,3r,5s,6r)-2,6-Bis(hydroxymethyl)piperidine-3,4,5-triol
CAS: 119557-99-2
CID: 159496
Formula: C7H15NO5
MW: 193.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight193.20
XLogP3-2.4
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass193.09502258
Monoisotopic Mass193.09502258
Topological Polar Surface Area113 Ų
Heavy Atom Count13
Formal Charge0
Complexity151
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

Alternative Products

CatalogName
T20703-01Homonojirimycin
MH07032-01A-Homonojirimycin
TBZ0413α-Homonojirimycin
TBZ03787-O-β-D-Glucopyranosyl-α-homonojirimycin

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