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CHEBI:32212 - tetrangulol

ChEBI IDCHEBI:32212
ChEBI Nametetrangulol
Stars
DefinitionA member of the class of tetraphenes that is tetraphene-7,12-dione substituted by hydroxy groups at positions 1 and 8 and a methyl group at position 3.
Last Modified6 June 2016
DownloadsMolfile
FormulaC19H12O4
Net Charge0
Average Mass304.301
Monoisotopic Mass304.07356
SMILESCc1cc(O)c2c3c(ccc2c1)C(=O)c1c(O)cccc1C3=O
InChIInChI=1S/C19H12O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-8,20-21H,1H3
InChIKeyNFUYRESOTVGLRL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces cyanogenus (ncbitaxon:80860) - PubMed (21188999) Ethyl acetate extract of broth Strain: S 136
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
tetrangulol (CHEBI:32212) has role bacterial metabolite (CHEBI:76969)
tetrangulol (CHEBI:32212) is a p-quinones (CHEBI:25830)
tetrangulol (CHEBI:32212) is a phenols (CHEBI:33853)
tetrangulol (CHEBI:32212) is a tetraphenes (CHEBI:51067)
Incoming Relation(s)
19-hydroxy-8-O-methyltetrangulol (CHEBI:31062) has functional parent tetrangulol (CHEBI:32212)
19-hydroxytetrangulol (CHEBI:31063) has functional parent tetrangulol (CHEBI:32212)
8-O-methyltetrangulol (CHEBI:31145) has functional parent tetrangulol (CHEBI:32212)
IUPAC Name 
1,8-dihydroxy-3-methyltetraphene-7,12-dione
Synonyms  Source
TetrangulolKEGG COMPOUND
1,8-dihydroxy-3-methylbenzo[a]anthracene-7,12-dioneIUPAC
1,8-Dihydroxy-3-methylbenz(a)anthracene-7,12-dioneChemIDplus
Manual XrefsDatabases
C12397KEGG COMPOUND
Registry NumbersSources
Beilstein:2157415Beilstein
CAS:7414-92-8KEGG COMPOUND
CAS:7414-92-8ChemIDplus
Citations