Chemical Components in the PDB

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NSK : Summary

Code

NSK

One-letter code

X

Molecule name

N-SUCCINYL LYSINE

Synonyms

N~2~-(3-CARBOXYPROPANOYL)-L-LYSINE

Systematic names

ProgramVersionName
ACDLabs 10.04 N~2~-(3-carboxypropanoyl)-L-lysine
OpenEye OEToolkits 1.5.0 (2S)-6-amino-2-[(4-hydroxy-4-oxo-butanoyl)amino]hexanoic acid

Formula

C10 H18 N2 O5

Formal charge

0

Molecular weight

246.26 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(NC(C(=O)O)CCCCN)CCC(=O)O
SMILES CACTVS 3.341 NCCCC[CH](NC(=O)CCC(O)=O)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(CCN)CC(C(=O)O)NC(=O)CCC(=O)O
Canonical SMILES CACTVS 3.341 NCCCC[C@H](NC(=O)CCC(O)=O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(CCN)C[C@@H](C(=O)O)NC(=O)CCC(=O)O

IUPAC InChI

InChI=1S/C10H18N2O5/c11-6-2-1-3-7(10(16)17)12-8(13)4-5-9(14)15/h7H,1-6,11H2,(H,12,13)(H,14,15)(H,16,17)/t7-/m0/s1

IUPAC InChI key

XEOGRHZGJFTETQ-ZETCQYMHSA-N
NSK

wwPDB Information

Atom count

35 (17 without Hydrogen)

Polymer type

Bound ligand

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

UNK

Defined at

2007-04-05

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned