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Panosialin wA

CAT: 0931-TN10984-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10984-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
792162-72-2
Target
Glycosidase, Antibiotic
Related Pathways
Microbiology/Virology, Metabolism
Bioactivity
Panosialin wA inhibits α, β-glucosidase and mannosidase enzymes, but does not exhibit inhibitory activity against the influenza virus. However, it has a mild antibacterial effect.
Smiles
O=S(=O)(O)OC1=CC(O)=CC(=C1)CCCCCCCCCCCCC(C)C
Molecular Formula
C21H36O5S
Molecular Weight
400.57
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Panosialin wA

Panosialin wA is an aryl sulfate.

CAS Number792162-72-2
PubChem CID26176699
IUPAC Name[3-hydroxy-5-(13-methyltetradecyl)phenyl] hydrogen sulfate
Molecular FormulaC21H36O5S
Molecular Weight400.6
XLogP8.2
Topological Polar Surface Area92.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Heavy Atom Count27
Formal Charge0
Complexity458
SMILES
CC(C)CCCCCCCCCCCCC1=CC(=CC(=C1)OS(=O)(=O)O)O
InChI
InChI=1S/C21H36O5S/c1-18(2)13-11-9-7-5-3-4-6-8-10-12-14-19-15-20(22)17-21(16-19)26-27(23,24)25/h15-18,22H,3-14H2,1-2H3,(H,23,24,25)
InChIKey
SLCFAIQTHOPISH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Panosialin wA
CAS: 792162-72-2
CID: 26176699
Formula: C21H36O5S
MW: 400.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.6
XLogP38.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count15
Exact Mass400.22834542
Monoisotopic Mass400.22834542
Topological Polar Surface Area92.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity458
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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