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CHEBI:138237 - 2-hydroxy-7,8-dihydropteroic acid

ChEBI IDCHEBI:138237
ChEBI Name2-hydroxy-7,8-dihydropteroic acid
Stars
DefinitionA member of the class of pteroic acids that is 7,8-dihydropteroic acid carrying a phenolic hydroxy substituent at the position ortho to the carboxylic acid function.
Last Modified17 August 2017
SubmitterSteve
DownloadsMolfile
FormulaC14H14N6O4
Net Charge0
Average Mass330.304
Monoisotopic Mass330.10765
SMILESNc1nc2c(c(=O)n1)N=C(CNc1ccc(C(=O)O)c(O)c1)CN2
InChIInChI=1S/C14H14N6O4/c15-14-19-11-10(12(22)20-14)18-7(5-17-11)4-16-6-1-2-8(13(23)24)9(21)3-6/h1-3,16,21H,4-5H2,(H,23,24)(H4,15,17,19,20,22)
InChIKeyGIQHIMWSWCCNJG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mycobacterium tuberculosis (ncbitaxon:1773) - PubMed (23118010)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxy-7,8-dihydropteroic acid (CHEBI:138237) has functional parent 7,8-dihydropteroic acid (CHEBI:4581)
2-hydroxy-7,8-dihydropteroic acid (CHEBI:138237) has role bacterial xenobiotic metabolite (CHEBI:76976)
2-hydroxy-7,8-dihydropteroic acid (CHEBI:138237) is a monohydroxybenzoic acid (CHEBI:25389)
2-hydroxy-7,8-dihydropteroic acid (CHEBI:138237) is a pteroic acids (CHEBI:38795)
IUPAC Name 
4-{[(2-amino-4-oxo-1,4,7,8-tetrahydropteridin-6-yl)methyl]amino}-2-hydroxybenzoic acid
Synonym  Source
H2PtePASChEBI
Citations