Chem
J-GLOBAL ID：200907026260827242   Nikkaji number：J47.923C

Kuwanon G

クワノンG
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： C40H36O11
Molecular formula furigana： C40-H36-O11
Molecular weight： 692.717
InChI： InChI=1S/C40H36O11/c1-18(2)4-8-26-38(50)36-33(48)17-32(47)35(40(36)51-39(26)25-11-7-22(43)16-31(25)46)28-13-19(3)12-27(23-9-5-20(41)14-29(23)44)34(28)37(49)24-10-6-21(42)15-30(24)45/h4-7,9-11,13-17,27-28,34,41-48H,8,12H2,1-3H3/t27-,28-,34-/m0/s1
InChI key： APPXYONGBIXGRO-AIQWNVMPSA-N
SMILES： CC(=CCc1c(oc2c([C@H]3C=C(C)C[C@H]([C@@H]3C(=O)c3ccc(O)cc3O)c3ccc(O)cc3O)c(O)cc(O)c2c1=O)c1ccc(O)cc1O)C
Systematic name  (3)：
  • 8-[(1S)-6α-(2,4-ジヒドロキシベンゾイル)-5β-(2,4-ジヒドロキシフェニル)-3-メチル-2-シクロヘキセン-1β-イル]-2-(2,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-3-(3-メチル-2-ブテニル)-4H-1-ベンゾピラン-4-オン
  • 8-[(1S,5R,6S)-6-(2,4-ジヒドロキシベンゾイル)-5-(2,4-ジヒドロキシフェニル)-3-メチルシクロヘキサ-2-エン-1-イル]-2-(2,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-3-(3-メチルブタ-2-エン-1-イル)-4H-クロメン-4-オン
  • 8-[(1S,5R,6S)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one
Other name (5)：
  • Albanin F
  • アルバニンF
  • クワノンG
  • Kuwanon G
  • 8-[(1S)-6α-(2,4-Dihydroxybenzoyl)-5β-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1β-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS registry number： 75629-19-5
KEGG COMPOUND： C10099
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