Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 05:24:50 UTC
Update Date2022-08-31 06:37:34 UTC
MiMeDB IDMMDBc0014364
Metabolite Identification
Common NameX-14881 E
Description8-O-methyltetrangulol belongs to the class of organic compounds known as angucyclines. These are polyketides with a structure based on then benz[a]anthracene skeleton, with the particularity that the central ring of the anthracene moiety is a para-quinone. 8-O-methyltetrangulol is an extremely weak basic (essentially neutral) compound (based on its pKa).
Structure
Synonyms
ValueSource
1-Hydroxy-8-methoxy-3-methylbenzo[a]anthracene-7,12-dioneChEBI
Chemical FormulaC20H14O4
Average Molecular Weight318.328
Monoisotopic Molecular Weight318.089208931
IUPAC NameNot Available
Traditional NameNot Available
CAS Registry NumberNot Available
SMILESNot Available
InChI Identifier
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
InChI KeyYCYXQISGHUDFRO-UHFFFAOYSA-N