ARTEMETHER

Search structure
Synonyms:
Status: Approved (2009)
Entry Type: Small molecule
Molecule Category: Parent Prodrug
ATC: P01BE02
UNII: C7D6T3H22J

Structure
InChI Key SXYIRMFQILZOAM-HVNFFKDJSA-N
Smile CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3
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

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H26O5
Molecular Weight 298.38
AlogP 2.84
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 1.0
Polar Surface Area 46.15
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 21.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Ferriprotoporphyrin IX inhibitor DailyMed Wikipedia Wikipedia

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Malaria 4 D008288 ClinicalTrials
Fever 3 D005334 ClinicalTrials
Malaria, Falciparum 3 D016778 ClinicalTrials
Malaria, Vivax 3 D016780 ClinicalTrials
Schistosomiasis haematobia 2 D012553 ClinicalTrials
HIV Infections 1 D015658 ClinicalTrials
Neoplasms 1 D009369 ClinicalTrials

Related Entries

Scaffolds

Mixture

Cross References

Resources Reference
CAS NUMBER 71963-77-4
ChEBI 195280
ChEMBL CHEMBL566534
DrugBank DB06697
DrugCentral 245
EPA CompTox DTXSID7040651
FDA SRS C7D6T3H22J
Human Metabolome Database HMDB0015643
Guide to Pharmacology 9955
PDB D8Z
PubChem 68911
SureChEMBL SCHEMBL1650501
ZINC ZINC000014263142
CONTENTS