Chem
J-GLOBAL ID：200907072418407639   Nikkaji number：J19.775K

Cassiamin C

カッシアミンC
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： C30H18O8
Molecular formula furigana： C30-H18-O8
Molecular weight： 506.466
InChI： InChI=1S/C30H18O8/c1-11-9-15-23(29(37)21-13(25(15)33)5-3-7-17(21)31)27(35)19(11)20-12(2)10-16-24(28(20)36)30(38)22-14(26(16)34)6-4-8-18(22)32/h3-10,31-32,35-36H,1-2H3
InChI key： VUPMYTWJSPRETC-UHFFFAOYSA-N
SMILES： Cc1cc2C(=O)c3cccc(O)c3C(=O)c2c(O)c1c1c(C)cc2C(=O)c3cccc(O)c3C(=O)c2c1O
Systematic name  (4)：
  • 1,1′,8,8′-テトラヒドロキシ-3,3′-ジメチル-2,2′-ビ[9,10-アントラキノン]
  • 1,1′,8,8′-テトラヒドロキシ-3,3′-ジメチル[2,2′-ビアントラセン]-9,9′,10,10′-テトラオン
  • 1,1',8,8'-テトラヒドロキシ-3,3'-ジメチル-9H,9'H,10H,10'H-[2,2'-ビアントラセン]-9,9',10,10'-テトラオン
  • 1,1',8,8'-tetrahydroxy-3,3'-dimethyl-9H,9'H,10H,10'H-[2,2'-bianthracene]-9,9',10,10'-tetrone
Other name (4)：
  • カッシアミンC
  • Cassiamin C
  • 1,1′,8,8′-Tetrahydroxy-3,3′-dimethyl-2,2′-bi[9,10-anthraquinone]
  • 1,1′,8,8′-Tetrahydroxy-3,3′-dimethyl[2,2′-bianthracene]-9,9′,10,10′-tetrone
CAS registry number： 27567-11-9
KEGG COMPOUND： C10308
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