Artesunate and amodiaquine
4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;4-oxo-4-[[(1R,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoic acid
Molecular Identity
Artesunate and amodiaquine
4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;4-oxo-4-[[(1R,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoic acid
PubChem CID: 16045195
2D Structure
Properties
C39H50ClN3O9
Molecular Formula
740.30
Molecular Weight
g/mol
739.3236
Exact Mass
Da
149
TPSA
May have limited oral absorption
3
H-Bond Donors
12
H-Bond Acceptors
1030
Complexity
SMILES
Canonical SMILES
SMILES: CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.CC1CCC2C(C(OC3C24C1CCC(O3)(OO4)C)OC(=O)CCC(=O)O)CIsomeric SMILES
SMILES: CCN(CC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.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(=O)CCC(=O)O)CSynonyms(11)
RefChem:560119Artesunate and amodiaquineartesunate & amodiaquineartesunate + amodiaquineartesunate / amodiaquineWinthropArsucameCoarsucamTrimalactAmodiaquine / Artesunate944945-14-6
Data from PubChem (NCBI)
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Trials and conditions connected to Artesunate and amodiaquine
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