CP5

(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}-2-PHENYLACRYLATE

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

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Chemical Details

Formal Charge-1
Atom Count21
Chiral Atom Count0
Bond Count21
Aromatic Bond Count6
2D diagram of CP5

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Chemical Component Summary

Name(2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}-2-PHENYLACRYLATE
Systematic Name (OpenEye OEToolkits)(Z)-2-phenyl-3-phosphooxy-prop-2-enoate
FormulaC9 H6 O5 P
Molecular Weight225.115
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C([O-])\C(=C/OP(=O)=O)c1ccccc1
SMILESCACTVS3.385[O-]C(=O)C(=CO[P](=O)=O)c1ccccc1
SMILESOpenEye OEToolkits1.7.5c1ccc(cc1)C(=COP(=O)=O)C(=O)[O-]
Canonical SMILESCACTVS3.385 [O-]C(=O)C(=C\O[P](=O)=O)/c1ccccc1
Canonical SMILESOpenEye OEToolkits1.7.5 c1ccc(cc1)/C(=C/OP(=O)=O)/C(=O)[O-]
InChIInChI1.03 InChI=1S/C9H7O5P/c10-9(11)8(6-14-15(12)13)7-4-2-1-3-5-7/h1-6H,(H,10,11)/p-1/b8-6-
InChIKeyInChI1.03 WSMRUPUEYOBWRC-VURMDHGXSA-M

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB02514 
Name(2Z)-3-{[Oxido(oxo)phosphoranyl]oxy}-2-phenylacrylate
Groups experimental
Synonyms(2Z)-3-{[Oxido(oxo)phosphoranyl]oxy}-2-phenylacrylate
CAS number2007-07-0

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 16133778