Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 07:23:51 UTC
Update Date2024-10-17 16:21:42 UTC
Metabolite IDMMDBc0016864
Metabolite Identification
Common NameNorsolorinic acid
Descriptionnorsolorinic acid, also known as norsolorinate, belongs to the class of organic compounds known as hydroxyanthraquinones. Hydroxyanthraquinones are compounds containing a hydroxyanthraquinone moiety, which consists of an anthracene bearing a quinone, and hydroxyl group. norsolorinic acid is an extremely weak basic (essentially neutral) compound (based on its pKa). A polyketide that is anthraquinone bearing four hydroxy substituents at positions 1, 3, 6 and 8 as well as a hexanoyl substituent at position 2.
Structure
Synonyms
ValueSource
NorsolorinateKegg
2-Hexanoyl-1,3,6,8-tetrahydroxy-9,10-anthraquinoneKegg
Molecular FormulaC20H18O7
Average Mass370.357
Monoisotopic Mass370.10525292
IUPAC Name2-hexanoyl-1,3,6,8-tetrahydroxy-9,10-dihydroanthracene-9,10-dione
Traditional Name2-hexanoyl-1,3,6,8-tetrahydroxyanthracene-9,10-dione
CAS Registry NumberNot Available
SMILES
CCCCCC(=O)C1=C(O)C=C2C(=O)C3=CC(O)=CC(O)=C3C(=O)C2=C1O
InChI Identifier
InChI=1S/C20H18O7/c1-2-3-4-5-12(22)17-14(24)8-11-16(20(17)27)19(26)15-10(18(11)25)6-9(21)7-13(15)23/h6-8,21,23-24,27H,2-5H2,1H3
InChI KeyXIJDBHLQUYAZJI-UHFFFAOYSA-N