DAL

D-ALANINE

Created: 1999-07-08
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count1
Bond Count12
Aromatic Bond Count0
2D diagram of DAL

Chemical Component Summary

NameD-ALANINE
Systematic Name (OpenEye OEToolkits)(2R)-2-aminopropanoic acid
FormulaC3 H7 N O2
Molecular Weight89.093
TypeD-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)C(N)C
SMILESCACTVS3.341C[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CC(C(=O)O)N
Canonical SMILESCACTVS3.341 C[C@@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C[C@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1
InChIKeyInChI1.03 QNAYBMKLOCPYGJ-UWTATZPHSA-N

Drug Info: DrugBank

DrugBank IDDB01786 
NameD-Alanine
Groups experimental
DescriptionThe D-enantiomer of alanine.
Synonyms
  • D-Alanine
  • (R)-alanine
  • D-Ala
  • D-α-aminopropionic acid
  • DAL
CAS number338-69-2

Drug Targets

NameTarget SequencePharmacological ActionActions
ThermolysinMKRKMKMKLVRFGLAAGLAAQVFFLPYNALASTEHVTWNQQFQTPQFISG...unknown
D-alanyl-D-alanine carboxypeptidaseMVSGTVGRGTALGAVLLALLAVPAQAGTAAAADLPAPDDTGLQAVLHTAL...unknown
Monocarboxylate transporter 10MVLSQEEPDSARGTSEAQPLGPAPTGAAPPPGPGPSDSPEAAVEKVEVEL...unknowninhibitor
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 7311725, 71080
ChEMBL CHEMBL66693
ChEBI CHEBI:15570, CHEBI:57416
CCDC/CSD DLALNI01, DLALNI06, IMOCAO, DLALNI07, BOQTEG, HOSLIL, DLALNI12, IMEGIR, DLALNI15, IBEGEC, DLALNI11, DLALNI09, DLALNI17, DLALNI21, DLALNI16, DLALNI18, DLALNI20, DLALNI10, DLALNI19, DLALNI14, NELPUP, DLALNI13, DLALNI05, DEKYOJ, HOSLEH, DLALNI08, FITHIZ, DENVAW, ALUCAL05, ALAHCL, IWOJIQ
COD 2012001, 2105146, 2105149, 2105145, 2105143, 2105151, 2105155, 2105150, 2105152, 2105154, 2105144, 2105153, 2105148, 2105147, 4501605, 7050083