Melphalan

Systematic / IUPAC Name: 4-[Bis(2-chloroethyl)amino]phenylalanine

ID: Reference2287

Other Names: Sarcolysin;
Merphalan;
Sarcolysine;
Mephalan;
Sarcoclorin ; more

Formula: C13H18Cl2N2O2

Class: Therapeutics/Prescription Drugs

Spectral Data

Melphalan mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/19/2015 11:03:11 AM
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Identificators

InChI InChI=1S/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)
InChI Key SGDBTWWWUNNDEQ-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1CC(C(=O)O)N)N(CCCl)CCCl
CAS 148823
Splash
Other Names Sarcolysin;
Merphalan;
Sarcolysine;
Mephalan;
Sarcoclorin;
Sarkolysin;
Medfalan;
Merfalan;
4-[Bis(2-chloroethyl)amino]phenylalanine;
Phenylalanine, 4-[bis(2-chloroethyl)amino]-;
2-Amino-3-{4-[bis(2-chloroethyl)amino]phenyl}propanoic acid

In Other Databases

ChEMBL CHEMBL429405
ChemIDPlus 000148823; 000531760; 013045948; AY3360000
KEGG D00369; C19256
Wikipedia Melphalan
ChemSpider 3913
PubChem 4053