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Swainsonine

CAT: 0127-BICL4200-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0127-BICL4200-01Size:1 mg
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CAS Number
72741-87-8
Synonyms
(1S,2R,8R,8aR) -1,2,3,5,6,7,8,8a-Octahydroindolizine-1,2,8-triol
MDL Number
MFCD00017554
Purity
>99%
Smiles
O[C@@H]1CCCN2C[C@@H](O)[C@@H](O)[C@@H]12
Storage Conditions
Store at -20°C

Chemical Information

Swainsonine

Swainsonine is an indolizidine alkaloid isolated from the plant Swainsona canescens with three hydroxy substituents at positions 1, 2 and 8. It has a role as an antineoplastic agent, an immunological adjuvant, an EC 3.2.1.114 (mannosyl-oligosaccharide 1,3-1,6-alpha-mannosidase) inhibitor and a plant metabolite.

CAS Number72741-87-8
PubChem CID51683
IUPAC Name(1S,2R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2,8-triol
Molecular FormulaC8H15NO3
Molecular Weight173.21
XLogP-1.3
Topological Polar Surface Area63.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity176
SMILES
C1C[C@H]([C@@H]2[C@@H]([C@@H](CN2C1)O)O)O
InChI
InChI=1S/C8H15NO3/c10-5-2-1-3-9-4-6(11)8(12)7(5)9/h5-8,10-12H,1-4H2/t5-,6-,7-,8-/m1/s1
InChIKey
FXUAIOOAOAVCGD-WCTZXXKLSA-N
Chemical Structure
2D Structure
2D structure of Swainsonine
CAS: 72741-87-8
CID: 51683
Formula: C8H15NO3
MW: 173.21
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight173.21
XLogP3-1.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass173.10519334
Monoisotopic Mass173.10519334
Topological Polar Surface Area63.9 Ų
Heavy Atom Count12
Formal Charge0
Complexity176
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
sc-201362DSwainsonine

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