Chem
J-GLOBAL ID:201107040248668709   Nikkaji number:J2.899.618G

Yungensin A

ユンゲンシンA
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: C35H44O8
Molecular formula furigana: C35-H44-O8
Molecular weight: 592.729
InChI: InChI=1S/C35H44O8/c1-9-11-25(37)27-29(39)23(28(38)22-15-16-34(6,7)43-31(22)27)18-24-30(40)26(21(5)36)33(42)35(8,32(24)41)17-14-20(4)13-10-12-19(2)3/h12,14-16,38-39,41-42H,9-11,13,17-18H2,1-8H3/b20-14+
InChI key: YOGGZLWMZHDOQP-XSFVSMFZSA-N
SMILES: CCCC(=O)c1c(O)c(CC2=C(O)C(C)(C/C=C(\C)/CCC=C(C)C)C(=C(C(=O)C)C2=O)O)c(O)c2C=CC(C)(C)Oc12
Systematic name  (3):
  • 1-[2,2-ジメチル-5,7-ジヒドロキシ-6-[[2,4-ジヒドロキシ-3-メチル-3-[(2E)-3,7-ジメチル-2,6-オクタジエニル]-5-アセチル-6-オキソ-1,4-シクロヘキサジエニル]メチル]-2H-1-ベンゾピラン-8-イル]-1-ブタノン
  • 2-アセチル-6-[(8-ブタノイル-5,7-ジヒドロキシ-2,2-ジメチル-2H-クロメン-6-イル)メチル]-4-[(2E)-3,7-ジメチルオクタ-2,6-ジエン-1-イル]-3,5-ジヒドロキシ-4-メチルシクロヘキサ-2,5-ジエン-1-オン
  • 2-acetyl-6-[(8-butanoyl-5,7-dihydroxy-2,2-dimethyl-2H-chromen-6-yl)methyl]-4-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3,5-dihydroxy-4-methylcyclohexa-2,5-dien-1-one
Other name (3):
  • 1-[2,2-Dimethyl-5,7-dihydroxy-6-[[2,4-dihydroxy-3-methyl-3-[(2E)-3,7-dimethyl-2,6-octadienyl]-5-acetyl-6-oxo-1,4-cyclohexadienyl]methyl]-2H-1-benzopyran-8-yl]-1-butanone
  • ユンゲンシンA
  • Yungensin A
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