D11

D-PHOSPHOTHREONINE

Created: 2006-11-15
Last modified:  2024-09-27

Find related ligands:

Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count2
Bond Count21
Aromatic Bond Count0
2D diagram of D11

Chemical Component Summary

NameD-PHOSPHOTHREONINE
SynonymsO-PHOSPHONO-D-THREONINE
Systematic Name (OpenEye OEToolkits)(2R,3S)-2-amino-3-phosphonooxy-butanoic acid
FormulaC4 H10 N O6 P
Molecular Weight199.099
TypeD-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=P(O)(O)OC(C(N)C(=O)O)C
SMILESCACTVS3.341C[CH](O[P](O)(O)=O)[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CC(C(C(=O)O)N)OP(=O)(O)O
Canonical SMILESCACTVS3.341 C[C@H](O[P](O)(O)=O)[C@@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C[C@@H]([C@H](C(=O)O)N)OP(=O)(O)O
InChIInChI1.03 InChI=1S/C4H10NO6P/c1-2(3(5)4(6)7)11-12(8,9)10/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10)/t2-,3+/m0/s1
InChIKeyInChI1.03 USRGIUJOYOXOQJ-STHAYSLISA-N

Drug Info: DrugBank

DrugBank IDDB02482 
NamePhosphonothreonine
Groups experimental
DescriptionThe phosphoric acid ester of threonine. Used as an identifier in the analysis of peptides, proteins, and enzymes. [PubChem]
SynonymsPhosphonothreonine

Drug Targets

NameTarget SequencePharmacological ActionActions
Protein kinase C theta typeMSPFLRIGLSNFDCGSCQSCQGEAVNPYCAVLVKEYVESENGQMYIQKKP...unknown
Aurora kinase AMDRSKENCISGPVKATAPVGGPKRVLVTQQFPCQNPLPVNSGQAQRVLCP...unknown
Mitogen-activated protein kinase 1MAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVR...unknown
cAMP-dependent protein kinase catalytic subunit alphaMGNAAAAKKGSEQESVKEFLAKAKEDFLKKWESPAQNTAHLDQFERIKTL...unknown
cAMP-dependent protein kinase catalytic subunit betaMGNAATAKKGSEVESVKEFLAKAKEDFLKKWENPTQNNAGLEDFERKKTL...unknown
View More
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 10976469