Chemical Components in the PDB

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UGY : Summary

Code

UGY

One-letter code

G

Molecule name

(2S)-amino(carbamoylamino)ethanoic acid

Systematic names

ProgramVersionName
ACDLabs 12.01 (2S)-amino(carbamoylamino)ethanoic acid
OpenEye OEToolkits 1.7.6 (2S)-2-(aminocarbonylamino)-2-azanyl-ethanoic acid

Formula

C3 H7 N3 O3

Formal charge

0

Molecular weight

133.106 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=C(N)NC(N)C(=O)O
SMILES CACTVS 3.370 N[CH](NC(N)=O)C(O)=O
SMILES OpenEye OEToolkits 1.7.6 C(C(=O)O)(N)NC(=O)N
Canonical SMILES CACTVS 3.370 N[C@@H](NC(N)=O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.7.6 [C@H](C(=O)O)(N)NC(=O)N

IUPAC InChI

InChI=1S/C3H7N3O3/c4-1(2(7)8)6-3(5)9/h1H,4H2,(H,7,8)(H3,5,6,9)/t1-/m0/s1

IUPAC InChI key

VTFWFHCECSOPSX-SFOWXEAESA-N
UGY

wwPDB Information

Atom count

16 (9 without Hydrogen)

Polymer type

Amino Acid

Type description

PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

GLY

Defined at

2012-03-20

Last modified at

2020-06-17

Status

Released

Obsoleted

Not Assigned