Chem
J-GLOBAL ID：200907074824957081   Nikkaji number：J156.709H

2-Isoprenylemodin

2-イソプレニルエモジン
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： C20H18O5
Molecular formula furigana： C20-H18-O5
Molecular weight： 338.359
InChI： InChI=1S/C20H18O5/c1-9(2)4-5-11-14(21)8-13-17(19(11)24)20(25)16-12(18(13)23)6-10(3)7-15(16)22/h4,6-8,21-22,24H,5H2,1-3H3
InChI key： WQTDARJAYXTHNU-UHFFFAOYSA-N
SMILES： CC(=CCc1c(O)cc2C(=O)c3cc(C)cc(O)c3C(=O)c2c1O)C
Systematic name  (3)：
  • 1,3,8-トリヒドロキシ-6-メチル-2-(3-メチル-2-ブテニル)-9,10-アントラキノン
  • 1,3,8-トリヒドロキシ-6-メチル-2-(3-メチルブタ-2-エン-1-イル)-9,10-ジヒドロアントラセン-9,10-ジオン
  • 1,3,8-trihydroxy-6-methyl-2-(3-methylbut-2-en-1-yl)-9,10-dihydroanthracene-9,10-dione
Other name (3)：
  • 2-イソプレニルエモジン
  • 2-Isoprenylemodin
  • 1,3,8-Trihydroxy-6-methyl-2-(3-methyl-2-butenyl)-9,10-anthraquinone
CAS registry number： 82345-58-2
KEGG COMPOUND： C10360
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