Chemical Components in the PDB

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19W : Summary

Code

19W

One-letter code

X

Molecule name

5-(aminooxy)-L-norvaline

Systematic names

ProgramVersionName
ACDLabs 12.01 5-(aminooxy)-L-norvaline
OpenEye OEToolkits 1.7.6 (2S)-2-azanyl-5-azanyloxy-pentanoic acid

Formula

C5 H12 N2 O3

Formal charge

0

Molecular weight

148.16 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=C(O)C(N)CCCON
SMILES CACTVS 3.385 NOCCC[CH](N)C(O)=O
SMILES OpenEye OEToolkits 1.7.6 C(CC(C(=O)O)N)CON
Canonical SMILES CACTVS 3.385 NOCCC[C@H](N)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.7.6 C(C[C@@H](C(=O)O)N)CON

IUPAC InChI

InChI=1S/C5H12N2O3/c6-4(5(8)9)2-1-3-10-7/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1

IUPAC InChI key

GFOZTGXHZSBIOB-BYPYZUCNSA-N
19W

wwPDB Information

Atom count

22 (10 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

No

Standard parent

Not Assigned

Defined at

2012-11-12

Last modified at

2013-08-16

Status

Released

Obsoleted

Not Assigned