EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:25814 - p-N,N-bis(2-chloroethyl)amino-D-phenylalanine

ChEBI IDCHEBI:25814
ChEBI Namep-N,N-bis(2-chloroethyl)amino-D-phenylalanine
Stars
ASCII Namep-N,N-bis(2-chloroethyl)amino-D-phenylalanine
Last Modified19 December 2014
DownloadsMolfile
FormulaC13H18Cl2N2O2
Net Charge0
Average Mass305.205
Monoisotopic Mass304.07453
SMILESN[C@H](Cc1ccc(N(CCCl)CCCl)cc1)C(=O)O
InChIInChI=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)/t12-/m1/s1
InChIKeySGDBTWWWUNNDEQ-GFCCVEGCSA-N
ChEBI Ontology
Outgoing Relation(s)
p-N,N-bis(2-chloroethyl)amino-D-phenylalanine (CHEBI:25814) has role mutagen (CHEBI:25435)
p-N,N-bis(2-chloroethyl)amino-D-phenylalanine (CHEBI:25814) is a D-phenylalanine derivative (CHEBI:84143)
p-N,N-bis(2-chloroethyl)amino-D-phenylalanine (CHEBI:25814) is a D-α-amino acid (CHEBI:16733)
p-N,N-bis(2-chloroethyl)amino-D-phenylalanine (CHEBI:25814) is a organochlorine compound (CHEBI:36683)
Synonyms  Source
p-N,N-di-(2-chloroethyl)amino-D-phenylalanineChEBI
CB3026ChEBI
D-MelphalanKEGG COMPOUND
Manual XrefsDatabases
C19442KEGG COMPOUND
Registry NumbersSources
CAS:13045-94-8KEGG COMPOUND