Chemical Components in the PDB

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PGH : Summary

Code

PGH

One-letter code

X

Molecule name

PHOSPHOGLYCOLOHYDROXAMIC ACID

Systematic names

ProgramVersionName
ACDLabs 10.04 2-(hydroxyamino)-2-oxoethyl dihydrogen phosphate
OpenEye OEToolkits 1.5.0 [2-(hydroxyamino)-2-oxo-ethyl] dihydrogen phosphate

Formula

C2 H6 N O6 P

Formal charge

0

Molecular weight

171.046 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 O=P(O)(O)OCC(=O)NO
SMILES CACTVS 3.341 ONC(=O)CO[P](O)(O)=O
SMILES OpenEye OEToolkits 1.5.0 C(C(=O)NO)OP(=O)(O)O
Canonical SMILES CACTVS 3.341 ONC(=O)CO[P](O)(O)=O
Canonical SMILES OpenEye OEToolkits 1.5.0 C(C(=O)NO)OP(=O)(O)O

IUPAC InChI

InChI=1S/C2H6NO6P/c4-2(3-5)1-9-10(6,7)8/h5H,1H2,(H,3,4)(H2,6,7,8)

IUPAC InChI key

BAXHHWZKQZIJID-UHFFFAOYSA-N
PGH

wwPDB Information

Atom count

16 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned