2PB

2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE

Created:2004-03-26
Last modified:  2024-09-27

Help

Find related ligands:

Chemical Details

Formal Charge-2
Atom Count18
Chiral Atom Count0
Bond Count18
Aromatic Bond Count6
2D diagram of 2PB

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

Name2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE
Systematic Name (OpenEye OEToolkits)2-oxidophosphonoyloxybenzoate
FormulaC7 H5 O5 P
Molecular Weight200.085
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P([O-])Oc1ccccc1C([O-])=O
SMILESCACTVS3.341[O-]C(=O)c1ccccc1O[PH]([O-])=O
SMILESOpenEye OEToolkits1.5.0c1ccc(c(c1)C(=O)[O-])OP(=O)[O-]
Canonical SMILESCACTVS3.341 [O-]C(=O)c1ccccc1O[PH]([O-])=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(c(c1)C(=O)[O-])O[P@H](=O)[O-]
InChIInChI1.03 InChI=1S/C7H7O5P/c8-7(9)5-3-1-2-4-6(5)12-13(10)11/h1-4,13H,(H,8,9)(H,10,11)/p-2
InChIKeyInChI1.03 BTPFLIXGJHTRNG-UHFFFAOYSA-L

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB04340 
Name2-[(Dioxidophosphoranyl)oxy]benzoate
Groups experimental
Synonyms2-[(Dioxidophosphoranyl)oxy]benzoate

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
D-alanyl-D-alanine carboxypeptidaseMVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTAL...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 5287483