MLU

N-methyl-D-leucine

Created:	2010-08-06
Last modified:	2024-09-27

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46 entries where MLU is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	1
Bond Count	24
Aromatic Bond Count	0

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Chemical Component Summary
Name	N-methyl-D-leucine
Systematic Name (OpenEye OEToolkits)	(2R)-4-methyl-2-(methylamino)pentanoic acid
Formula	C₇ H₁₅ N O₂
Molecular Weight	145.199
Type	D-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(NC)CC(C)C
SMILES	CACTVS	3.370	CN[CH](CC(C)C)C(O)=O
SMILES	OpenEye OEToolkits	1.7.6	CC(C)CC(C(=O)O)NC
Canonical SMILES	CACTVS	3.370	CN[C@H](CC(C)C)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(C)C[C@H](C(=O)O)NC
InChI	InChI	1.03	InChI=1S/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m1/s1
InChIKey	InChI	1.03	XJODGRWDFZVTKW-ZCFIWIBFSA-N

Drug Info: DrugBank

DrugBank ID	DB04487
Name	N-Methylleucine
Groups	experimental
Synonyms	N-Methylleucine
CAS number	31321-74-1

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
C-X-C motif chemokine 10	MNQTAILICCLIFLTLSGIQGVPLSRTVRCTCISISNQPVNPRSLEKLEI...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682