ASN

ASPARAGINE

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

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Chemical Details

Formal Charge0
Atom Count17
Chiral Atom Count1
Bond Count16
Aromatic Bond Count0
2D diagram of ASN

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Toggle HydrogenToggle Labels

Chemical Component Summary

NameASPARAGINE
Systematic Name (OpenEye OEToolkits)(2S)-2,4-bis(azanyl)-4-oxidanylidene-butanoic acid
FormulaC4 H8 N2 O3
Molecular Weight132.118
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(N)CC(N)C(=O)O
SMILESCACTVS3.370N[CH](CC(N)=O)C(O)=O
SMILESOpenEye OEToolkits1.7.2C(C(C(=O)O)N)C(=O)N
Canonical SMILESCACTVS3.370 N[C@@H](CC(N)=O)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.2 C([C@@H](C(=O)O)N)C(=O)N
InChIInChI1.03 InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1
InChIKeyInChI1.03 DCXYFEDJOCDNAF-REOHCLBHSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB00174 
NameAsparagine
Groups
  • investigational
  • nutraceutical
  • approved
DescriptionA non-essential amino acid that is involved in the metabolic control of cell functions in nerve and brain tissue. It is biosynthesized from aspartic acid and ammonia by asparagine synthetase. (From Concise Encyclopedia Biochemistry and Molecular Biology, 3rd ed)
Synonyms
  • (S)-2-amino-3-carbamoylpropanoic acid
  • L-2-aminosuccinamic acid
  • Aspartamic acid
  • L-aspartic acid β-amide
  • Asn
Brand Names
  • The Classeum Co., Ltd.
  • EXODERMA Brightening Mellow Foam
  • EXODERMA Brightening Peeling Gel
  • EXODERMA Calming Toner Pad
IndicationUsed for nutritional supplementation, also for treating dietary shortage or imbalance.
Categories
  • Amino Acids
  • Amino Acids, Basic
  • Amino Acids, Diamino
  • Amino Acids, Neutral
  • Amino Acids, Peptides, and Proteins
CAS number70-47-3

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Sodium-coupled neutral amino acid transportersMMHFKSGLELTELQNMTVPEDDNISNDSNDFTEVENGQINSKFISDRESR...unknowninhibitor
Neutral amino acid transporter B(0)MVADPPRDSKGLAAAEPTANGGLALASIEDQGAAAGGYCGSRDQVRRCLR...unknown
Asparagine synthetase [glutamine-hydrolyzing]MCGIWALFGSDDCLSVQCLSAMKIAHRGPDAFRFENVNGYTNCCFGFHRL...unknown
Asparagine--tRNA ligase, cytoplasmicMVLAELYVSDREGSDATGDGTKEKPFKTGLKALMTVGKEPFPTIYVDSQK...unknown
Isoaspartyl peptidase/L-asparaginaseMNPIVVVHGGGAGPISKDRKERVHQGMVRAATVGYGILREGGSAVDAVEG...unknownsubstrate
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 6992089, 6267
ChEMBL CHEMBL58832
ChEBI CHEBI:17196, CHEBI:58048
CCDC/CSD LIRLUW, ILUXOC, WAMPOQ, LIRMAD, LIRMEH, HUDJIA, COTZOB, NUYFUI01, NUYFUI, SUYWEP, MAPFIT, AYAQID
COD 2227303