CHEBI:31145 - 8-O-methyltetrangulol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 8-O-methyltetrangulol
ChEBI ID CHEBI:31145
ChEBI ASCII Name 8-O-methyltetrangulol
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H14O4
Net Charge 0
Average Mass 318.32276
Monoisotopic Mass 318.08921
InChI InChI=1S/C20H14O4/c1-10-8-11-6-7-13-18(16(11)14(21)9-10)20(23)12-4-3-5-15(24-2)17(12)19(13)22/h3-9,21H,1-2H3
InChIKey YCYXQISGHUDFRO-UHFFFAOYSA-N
SMILES COc1cccc2C(=O)c3c(ccc4cc(C)cc(O)c34)C(=O)c12
ChEBI Ontology
Outgoing 8-O-methyltetrangulol (CHEBI:31145) has functional parent tetrangulol (CHEBI:32212)
8-O-methyltetrangulol (CHEBI:31145) is a tetraphenes (CHEBI:51067)
IUPAC Name
1-hydroxy-8-methoxy-3-methyltetraphene-7,12-dione
Synonyms Sources
1-hydroxy-8-methoxy-3-methylbenzo[a]anthracene-7,12-dione IUPAC
8-O-Methyltetrangulol KEGG COMPOUND
Manual Xref Database
C12398 KEGG COMPOUND
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Last Modified
19 November 2008