Chemical Components in the PDB

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GG7 : Summary

Code

GG7

One-letter code

X

Molecule name

[(1R)-1-AMINOETHYL]PHOSPHONIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 [(1R)-1-aminoethyl]phosphonic acid
OpenEye OEToolkits 1.5.0 [(1R)-1-aminoethyl]phosphonic acid

Formula

C2 H8 N O3 P

Formal charge

0

Molecular weight

125.064 Da

SMILES

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

IUPAC InChI

InChI=1S/C2H8NO3P/c1-2(3)7(4,5)6/h2H,3H2,1H3,(H2,4,5,6)/t2-/m1/s1

IUPAC InChI key

UIQSKEDQPSEGAU-UWTATZPHSA-N
GG7

wwPDB Information

Atom count

15 (7 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2007-04-13

Last modified at

2023-11-03

Status

Released

Obsoleted

Not Assigned