Amonafide L-Malate
5-amino-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;(2S)-2-hydroxybutanedioic acid
Molecular Identity
Amonafide L-Malate
5-amino-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;(2S)-2-hydroxybutanedioic acid
PubChem CID: 10216431
2D Structure
Properties
C20H23N3O7
Molecular Formula
417.40
Molecular Weight
g/mol
417.1536
Exact Mass
Da
161
TPSA
May have limited oral absorption
4
H-Bond Donors
9
H-Bond Acceptors
566
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)N.C(C(C(=O)O)O)C(=O)OIsomeric SMILES
SMILES: CN(C)CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)N.C([C@@H](C(=O)O)O)C(=O)OSynonyms(20)
AMONAFIDE L-MALATEXanafideXAN-02AS1413Amonafide malate618863-54-0LI06Q37TEGXAN 02AS 1413RefChem:1122405-AMINO-2-(2-(DIMETHYLAMINO)ETHYL)-1H-BENZ(DE)ISOQUINOLINE-1,3(2H)-DIONE (2S)-2-YDROXYBUTANEDIOATEButanedioic Acid, 2-hydroxy-, (2S)-, compd. with 5-amino-2-(2-(dimethylamino)ethyl)-1h-benz(de)isoquinoline-1,3(2h)-dione (1:1)Amonafide l-malate [USAN]UNII-LI06Q37TEG5-Amino-2-(2-(dimethylamino)ethyl)-1H-benz(de)isoquinoline-1,3(2H)-dione (2S)-2- ydroxybutanedioate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Amonafide L-Malate
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