NLE

NORLEUCINE

Created:	1999-07-08
Last modified:	2024-09-27

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4 entries where NLE is found as a standalone ligand161 entries where NLE is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	1
Bond Count	21
Aromatic Bond Count	0

2D diagram of NLE

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Chemical Component Summary
Name	NORLEUCINE
Systematic Name (OpenEye OEToolkits)	(2S)-2-aminohexanoic acid
Formula	C₆ H₁₃ N O₂
Molecular Weight	131.173
Type	L-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)C(N)CCCC
SMILES	CACTVS	3.341	CCCC[CH](N)C(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CCCCC(C(=O)O)N
Canonical SMILES	CACTVS	3.341	CCCC[C@H](N)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCC[C@@H](C(=O)O)N
InChI	InChI	1.03	InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
InChIKey	InChI	1.03	LRQKBLKVPFOOQJ-YFKPBYRVSA-N

Drug Info: DrugBank

DrugBank ID	DB15458
Name	Norleucine
Groups	investigational
Description	Norleucine is under investigation in clinical trial NCT00081952 (Amino Acid Therapy for Hot Flashes in Postmenopausal Women).
Synonyms	L-NORLEUCINE Norleucine
Categories	Amino Acids Amino Acids, Peptides, and Proteins Aminocaproates
CAS number	327-57-1

Related Resource References

Resource Name	Reference
PubChem	21236, 6991974
ChEMBL	CHEMBL292439
ChEBI	CHEBI:18347, CHEBI:58455
CCDC/CSD	GOLVOS, GOLVIM01, GOLVIM02, GOLVUY, GOLWAF, GOLVIM, DLNLIT, FITLEZ, GOLVIM03, DLNLUA03, ZATPIX, ZATNUH, ZATNER
COD	4509815, 4509813

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