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Artemether

CAT: 0127-BUP16738-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP16738-03Size:100 mg
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CAS Number
71963-77-4
Synonyms
Dihydroartemisinin methyl ether, SM224, Dihydroqinghaosu methyl ether, CGP 56696
Purity
=98%
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]

Chemical Information

Artemether

Artemether is an artemisinin derivative that is artemisinin in which the lactone has been converted to the corresponding lactol methyl ether. It is used in combination with lumefantrine as an antimalarial for the treatment of multi-drug resistant strains of falciparum malaria. It has a role as an antimalarial. It is an organic peroxide, a sesquiterpenoid, a cyclic acetal, an artemisinin derivative and a semisynthetic derivative.

CAS Number71963-77-4
PubChem CID68911
IUPAC Name(1R,4S,5R,8S,9R,10S,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-HVNFFKDJSA-N
Chemical Structure
2D Structure
2D structure of Artemether
CAS: 71963-77-4
CID: 68911
Formula: C16H26O5
MW: 298.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
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

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