melphalan

Melphalan An alkylating nitrogen mustard that is used as an antineoplastic in the form of the levo isomer - MELPHALAN, the racemic mixture - MERPHALAN, and the dextro isomer - MEDPHALAN; toxic to bone marrow, but little vesicant action; potential carcinogen.

Molecular Formula: C₁₃H₁₈Cl₂N₂O₂

InChI: InChI=1/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1/f/h18H

InChIKey: InChIKey=SGDBTWWWUNNDEQ-MUSVCJDDDI
SMILES: C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl

Names:
    alkylating agent: crosslinks DNA
    melphalan
    (2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid

Registries:
    PubChem CID 460612
    PubChem ID 8149411