HDA

HADACIDIN

Created: 1999-07-08
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count12
Aromatic Bond Count0
2D diagram of HDA
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Chemical Component Summary

NameHADACIDIN
Systematic Name (OpenEye OEToolkits)2-[hydroxy(methanoyl)amino]ethanoic acid
FormulaC3 H5 N O4
Molecular Weight119.076
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)CN(O)C=O
SMILESCACTVS3.370ON(CC(O)=O)C=O
SMILESOpenEye OEToolkits1.7.0C(C(=O)O)N(C=O)O
Canonical SMILESCACTVS3.370 ON(CC(O)=O)C=O
Canonical SMILESOpenEye OEToolkits1.7.0 C(C(=O)O)N(C=O)O
InChIInChI1.03 InChI=1S/C3H5NO4/c5-2-4(8)1-3(6)7/h2,8H,1H2,(H,6,7)
InChIKeyInChI1.03 URJHVPKUWOUENU-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB02109 
NameHadacidin
Groups experimental
Synonyms
  • Hadacidine
  • N-hydroxyformamidoacetic acid
  • Hadacidin
  • N-formyl hydroxyaminoacetic acid
  • N-formyl-N- hydroxyaminoacetic acid
Categories
  • Amino Acids
  • Amino Acids, Peptides, and Proteins
  • Antibiotics, Antineoplastic
  • Antineoplastic Agents
  • Noxae
CAS number689-13-4

Drug Targets

NameTarget SequencePharmacological ActionActions
Adenylosuccinate synthetaseMGNNVVVLGTQWGDEGKGKIVDLLTERAKYVVRYQGGHNAGHTLVINGEK...unknown
Adenylosuccinate synthetase isozyme 1MSGTRASNDRPPGAGGVKRGRLQQEAAATGSRVTVVLGAQWGDEGKGKVV...unknown
Adenylosuccinate synthetaseMNIFDHQIKNVDKGNVVAILGAQWGDEGKGKIIDMLSEYSDITCRFNGGA...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 12717
ChEMBL CHEMBL331373
ChEBI CHEBI:43040
CCDC/CSD NAHACA