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Alpha-Artemether

CAT: 0931-T21064-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T21064-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
71939-51-0
Target
Parasite, Others
Related Pathways
Others, Microbiology/Virology
Bioactivity
Alpha-Artemether is a Quinghaosu derivative with antifungal and antimalarial activity.
Smiles
C[C@@H]1[C@]2([C@]34[C@](O[C@H]1OC)(O[C@](C)(OO3)CC[C@]4([C@H](C)CC2)[H])[H])[H]
Molecular Formula
C16H26O5
Molecular Weight
298.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

alpha-Artemether
CAS Number71939-51-0
PubChem CID104888
IUPAC Name(1R,4S,5R,8S,9R,10R,12R,13R)-10-methoxy-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane
Molecular FormulaC16H26O5
Molecular Weight298.37
XLogP3.1
Topological Polar Surface Area46.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity429
SMILES
C[C@@H]1CC[C@H]2[C@H]([C@@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC)C
InChI
InChI=1S/C16H26O5/c1-9-5-6-12-10(2)13(17-4)18-14-16(12)11(9)7-8-15(3,19-14)20-21-16/h9-14H,5-8H2,1-4H3/t9-,10-,11+,12+,13-,14-,15-,16-/m1/s1
InChIKey
SXYIRMFQILZOAM-CNNNLJIRSA-N
Chemical Structure
2D Structure
2D structure of alpha-Artemether
CAS: 71939-51-0
CID: 104888
Formula: C16H26O5
MW: 298.37
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.37
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass298.17802393
Monoisotopic Mass298.17802393
Topological Polar Surface Area46.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes