Chemical Components in the PDB

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FGL : Summary

Code

FGL

One-letter code

G

Molecule name

2-AMINOPROPANEDIOIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 aminopropanedioic acid
OpenEye OEToolkits 1.5.0 2-aminopropanedioic acid

Formula

C3 H5 N O4

Formal charge

0

Molecular weight

119.076 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=C(O)C(N)C(=O)O
SMILES CACTVS 3.341 NC(C(O)=O)C(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(C(=O)O)(C(=O)O)N
Canonical SMILES CACTVS 3.341 NC(C(O)=O)C(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(C(=O)O)(C(=O)O)N

IUPAC InChI

InChI=1S/C3H5NO4/c4-1(2(5)6)3(7)8/h1H,4H2,(H,5,6)(H,7,8)

IUPAC InChI key

JINBYESILADKFW-UHFFFAOYSA-N
FGL

wwPDB Information

Atom count

13 (8 without Hydrogen)

Polymer type

Amino Acid

Type description

L-PEPTIDE LINKING

Type code

ATOMP

Is modified

Yes

Standard parent

GLY

Defined at

1999-07-08

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned