D11
D-PHOSPHOTHREONINE
Created: | 2006-11-15 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 22 |
Chiral Atom Count | 2 |
Bond Count | 21 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | D-PHOSPHOTHREONINE |
Synonyms | O-PHOSPHONO-D-THREONINE |
Systematic Name (OpenEye OEToolkits) | (2R,3S)-2-amino-3-phosphonooxy-butanoic acid |
Formula | C4 H10 N O6 P |
Molecular Weight | 199.099 |
Type | D-PEPTIDE LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)OC(C(N)C(=O)O)C |
SMILES | CACTVS | 3.341 | C[CH](O[P](O)(O)=O)[CH](N)C(O)=O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(C(=O)O)N)OP(=O)(O)O |
Canonical SMILES | CACTVS | 3.341 | C[C@H](O[P](O)(O)=O)[C@@H](N)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C[C@@H]([C@H](C(=O)O)N)OP(=O)(O)O |
InChI | InChI | 1.03 | 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 |
InChIKey | InChI | 1.03 | USRGIUJOYOXOQJ-STHAYSLISA-N |
Drug Info: DrugBank
DrugBank ID | DB02482 |
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Name | Phosphonothreonine |
Groups | experimental |
Description | The phosphoric acid ester of threonine. Used as an identifier in the analysis of peptides, proteins, and enzymes. [PubChem] |
Synonyms | Phosphonothreonine |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
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Protein kinase C theta type | MSPFLRIGLSNFDCGSCQSCQGEAVNPYCAVLVKEYVESENGQMYIQKKP... | unknown | |
Aurora kinase A | MDRSKENCISGPVKATAPVGGPKRVLVTQQFPCQNPLPVNSGQAQRVLCP... | unknown | |
Mitogen-activated protein kinase 1 | MAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVR... | unknown | |
cAMP-dependent protein kinase catalytic subunit alpha | MGNAAAAKKGSEQESVKEFLAKAKEDFLKKWESPAQNTAHLDQFERIKTL... | unknown | |
cAMP-dependent protein kinase catalytic subunit beta | MGNAATAKKGSEVESVKEFLAKAKEDFLKKWENPTQNNAGLEDFERKKTL... | 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 Name | Reference |
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PubChem | 10976469 |