Chemical Components in the PDB

pdbe.org/chem
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NOT : Summary

Code

NOT

One-letter code

L

Molecule name

6-azido-L-norleucine

Synonyms

AZIDONORLEUCINE

Systematic names

ProgramVersionName
ACDLabs 10.04 6-azido-L-norleucine
OpenEye OEToolkits 1.5.0 (2S)-2-amino-6-azido-hexanoic acid

Formula

C6 H12 N4 O2

Formal charge

0

Molecular weight

172.185 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 [N-]=[N+]=N/CCCCC(N)C(=O)O
SMILES CACTVS 3.341 N[CH](CCCCN=[N+]=[N-])C(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(CCN=[N+]=[N-])CC(C(=O)O)N
Canonical SMILES CACTVS 3.341 N[C@@H](CCCCN=[N+]=[N-])C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(CCN=[N+]=[N-])C[C@@H](C(=O)O)N

IUPAC InChI

InChI=1S/C6H12N4O2/c7-5(6(11)12)3-1-2-4-9-10-8/h5H,1-4,7H2,(H,11,12)/t5-/m0/s1

IUPAC InChI key

HTFFMYRVHHNNBE-YFKPBYRVSA-N
NOT

wwPDB Information

Atom count

24 (12 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

LEU

Defined at

2009-05-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned