Chemical Components in the PDB

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OO9 : Summary

Code

OO9

One-letter code

X

Molecule name

oxidanyl dihydrogen phosphate

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 oxidanyl dihydrogen phosphate

Formula

H3 O5 P

Formal charge

0

Molecular weight

113.995 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 OO[P](O)(O)=O
SMILES OpenEye OEToolkits 2.0.7 OOP(=O)(O)O
Canonical SMILES CACTVS 3.385 OO[P](O)(O)=O
Canonical SMILES OpenEye OEToolkits 2.0.7 OOP(=O)(O)O

IUPAC InChI

InChI=1S/H3O5P/c1-5-6(2,3)4/h1H,(H2,2,3,4)

IUPAC InChI key

MPNNOLHYOHFJKL-UHFFFAOYSA-N
OO9

wwPDB Information

Atom count

9 (6 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2022-05-12

Last modified at

2022-08-05

Status

Released

Obsoleted

Not Assigned