Chem
J-GLOBAL ID：200907001908803732   Nikkaji number：J2.293.651D

Nogalonic acid methyl

ノガロン酸メチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H16O8
Molecular formula furigana： C21-H16-O8
Molecular weight： 396.351
InChI： InChI=1S/C21H16O8/c1-9(22)6-14(24)16-10(8-15(25)29-2)7-12-18(20(16)27)21(28)17-11(19(12)26)4-3-5-13(17)23/h3-5,7,23,27H,6,8H2,1-2H3
InChI key： QBPKMZSXGLNWOB-UHFFFAOYSA-N
SMILES： COC(=O)Cc1cc2C(=O)c3cccc(O)c3C(=O)c2c(O)c1C(=O)CC(=O)C
Systematic name  (4)：
  • 9,10-ジヒドロ-4,5-ジヒドロキシ-9,10-ジオキソ-3-(1,3-ジオキソブチル)-2-アントラセン酢酸メチル
  • 1,8-ジヒドロキシ-9,10-ジヒドロ-9,10-ジオキソ-2-(1,3-ジオキソブチル)アントラセン-3-酢酸メチル
  • メチル 2-[4,5-ジヒドロキシ-9,10-ジオキソ-3-(3-オキソブタノイル)-9,10-ジヒドロアントラセン-2-イル]アセタート
  • methyl 2-[4,5-dihydroxy-9,10-dioxo-3-(3-oxobutanoyl)-9,10-dihydroanthracen-2-yl]acetate
Other name (6)：
  • 9,10-Dihydro-4,5-dihydroxy-9,10-dioxo-3-(1,3-dioxobutyl)-2-anthraceneacetic acid methyl ester
  • ノガロン酸メチル
  • Nogalonic acid methyl
  • 1,8-Dihydroxy-9,10-dihydro-9,10-dioxo-2-(1,3-dioxobutyl)anthracene-3-acetic acid methyl ester
  • Nogalonic acid methyl ester
Show all
KEGG COMPOUND： C12415
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