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CHEBI:27701 - oxytetracycline

Default Structure
ChEBI IDCHEBI:27701
ChEBI Nameoxytetracycline
Stars
DefinitionA tetracycline used for treatment of infections caused by a variety of Gram positive and Gram negative microorganisms including Mycoplasma pneumoniae, Pasteurella pestis, Escherichia coli, Haemophilus influenzae (respiratory infections), and Diplococcus pneumoniae.
Secondary ChEBI IDsCHEBI:7871, CHEBI:25811, CHEBI:521157, CHEBI:596903
Last Modified19 September 2018
DownloadsMolfile
FormulaC22H24N2O9
Net Charge0
Average Mass460.439
Monoisotopic Mass460.14818
SMILES[H][C@@]12[C@@H](O)[C@@]3([H])C(=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C)C)C(=O)c1c(O)cccc1[C@@]3(C)O
InChIInChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25,27-29,32-33H,1-3H3,(H2,23,31)/t12-,13-,14+,17+,21-,22+/m1/s1
InChIKeyIWVCMVBTMGNXQD-PXOLEDIWSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Streptomyces rimosus (ncbitaxon:1927) - PubMed (1833366)
Roles Classification
Biological Roles:
antibacterial drug  A drug used to treat or prevent bacterial infections.
protein synthesis inhibitor  A compound, usually an anti-bacterial agent or a toxin, which inhibits the synthesis of a protein.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Applications:
antibacterial drug  A drug used to treat or prevent bacterial infections.
ophthalmology drug  Any compound used for the treatment of eye conditions or eye diseases.
antiinfective agent  A substance used in the prophylaxis or therapy of infectious diseases.
anti-inflammatory drug  A substance that reduces or suppresses inflammation.
ChEBI Ontology
Outgoing Relation(s)
oxytetracycline (CHEBI:27701) has role anti-inflammatory drug (CHEBI:35472)
oxytetracycline (CHEBI:27701) has role antibacterial agent (CHEBI:33282)
oxytetracycline (CHEBI:27701) has role antibacterial drug (CHEBI:36047)
oxytetracycline (CHEBI:27701) has role antiinfective agent (CHEBI:35441)
oxytetracycline (CHEBI:27701) has role antimicrobial agent (CHEBI:33281)
oxytetracycline (CHEBI:27701) has role bacterial metabolite (CHEBI:76969)
oxytetracycline (CHEBI:27701) has role ophthalmology drug (CHEBI:66981)
oxytetracycline (CHEBI:27701) has role protein synthesis inhibitor (CHEBI:48001)
oxytetracycline (CHEBI:27701) is a tetracyclines (CHEBI:26895)
oxytetracycline (CHEBI:27701) is tautomer of oxytetracycline zwitterion (CHEBI:133011)
Incoming Relation(s)
oxytetracycline zwitterion (CHEBI:133011) is tautomer of oxytetracycline (CHEBI:27701)
IUPAC Name 
(4S,4aR,5S,5aR,6S,12aS)-4-(dimethylamino)-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
INNs  Source
oxitetraciclinaChemIDplus
oxytetracyclinumChemIDplus
Synonyms  Source
5-HydroxytetracyclineChemIDplus
5-hydroxytetracycline dihydrateChEMBL
E703ChEMBL
NitoxChEMBL
NSC-757262ChEMBL
NSC-9169ChEMBL
Brand Names  Source
BerkmycenChEMBL
ChemocyclineChEMBL
GalenomycinChEMBL
Hi-tetChEMBL
ImperacinChEMBL
MicrotetChEMBL
Manual XrefsDatabases
2041DrugCentral
503BPDB
503VSDB
C00017127KNApSAcK
C06624KEGG COMPOUND
DB00595DrugBank
HMDB0014733HMDB
LMPK07000005LIPID MAPS
oxytetracyclineAlan Wood's Pesticides
OxytetracyclineWikipedia
Registry NumbersSources
Beilstein:2686362Beilstein
Reaxys:2714587Reaxys
Gmelin:623487Gmelin
CAS:79-57-2KEGG COMPOUND
CAS:79-57-2ChemIDplus
Citations