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CHEBI:142710 - 11a-hydroxychlortetracycline zwitterion

ChEBI IDCHEBI:142710
ChEBI Name11a-hydroxychlortetracycline zwitterion
Stars
DefinitionA zwitterion obtained by transfer of a proton from the 2-hydroxy group to the 1-amino group of 11a-hydroxychlortetracycline; major species at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC22H23ClN2O9
Net Charge0
Average Mass494.884
Monoisotopic Mass494.10921
SMILES[H][C@@]12C[C@@]3([H])C(O)(C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O)C(=O)[C@]1(O)C(=O)C(C(N)=O)=C([O-])[C@H]2[NH+](C)C
InChIInChI=1S/C22H23ClN2O9/c1-20(32)10-6-7-14(25(2)3)15(27)12(18(24)30)17(29)21(7,33)19(31)22(10,34)16(28)11-9(26)5-4-8(23)13(11)20/h4-5,7,10,14,26-27,32-34H,6H2,1-3H3,(H2,24,30)/t7-,10+,14-,20-,21+,22?/m0/s1
InChIKeyGAPUYPRPRQGEIU-PRVYJEFOSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
11a-hydroxychlortetracycline zwitterion (CHEBI:142710) is a an 11a-hydroxytetracyline zwitterion (CHEBI:144645)
11a-hydroxychlortetracycline zwitterion (CHEBI:142710) is a tetracyclines (CHEBI:26895)
11a-hydroxychlortetracycline zwitterion (CHEBI:142710) is a zwitterion (CHEBI:27369)
Synonym  Source
11a-hydroxychlortetracyclineSUBMITTER
UniProt Name  Source
11a-hydroxychlorotetracyclineUniProt
Citations