Chemical Components in the PDB

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DSG : Summary

Code

DSG

One-letter code

N

Molecule name

D-ASPARAGINE

Systematic names

ProgramVersionName
ACDLabs 10.04 D-asparagine
OpenEye OEToolkits 1.5.0 (2R)-2,4-diamino-4-oxo-butanoic acid

Formula

C4 H8 N2 O3

Formal charge

0

Molecular weight

132.118 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(N)CC(N)C(=O)O
SMILES CACTVS 3.341 N[CH](CC(N)=O)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(C(C(=O)O)N)C(=O)N
Canonical SMILES CACTVS 3.341 N[C@H](CC(N)=O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C([C@H](C(=O)O)N)C(=O)N

IUPAC InChI

InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m1/s1

IUPAC InChI key

DCXYFEDJOCDNAF-UWTATZPHSA-N
DSG

wwPDB Information

Atom count

17 (9 without Hydrogen)

Polymer type

Amino Acid

Type description

D-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

ASN

Defined at

2004-06-28

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned