Chem
J-GLOBAL ID:200907050650262783   Nikkaji number:J997.349D

6-(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl)-2,2-dimethyl-8-(3-phenylpropenoyl)-2H-1-benzopyran-5,7-diol

6-(3-アセチル-2,4,6-トリヒドロキシ-5-メチルベンジル)-2,2-ジメチル-8-(3-フェニルプロペノイル)-2H-1-ベンゾピラン-5,7-ジオール
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: C30H28O8
Molecular formula furigana: C30-H28-O8
Molecular weight: 516.546
InChI: InChI=1S/C30H28O8/c1-15-24(33)19(27(36)22(16(2)31)25(15)34)14-20-26(35)18-12-13-30(3,4)38-29(18)23(28(20)37)21(32)11-10-17-8-6-5-7-9-17/h5-13,33-37H,14H2,1-4H3
InChI key: DEZFNHCVIZBHBI-UHFFFAOYSA-N
SMILES: CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c3C=CC(C)(C)Oc3c(C(=O)C=Cc3ccccc3)c2O)c1O
Systematic name  (4):
  • 3-フェニル-1-[2,2-ジメチル-5,7-ジヒドロキシ-6-(2,4,6-トリヒドロキシ-5-メチル-3-アセチルベンジル)-2H-1-ベンゾピラン-8-イル]-2-プロペン-1-オン
  • 6-(3-アセチル-2,4,6-トリヒドロキシ-5-メチルベンジル)-2,2-ジメチル-8-(3-フェニルプロペノイル)-2H-1-ベンゾピラン-5,7-ジオール
  • 1-{6-[(3-アセチル-2,4,6-トリヒドロキシ-5-メチルフェニル)メチル]-5,7-ジヒドロキシ-2,2-ジメチル-2H-クロメン-8-イル}-3-フェニルプロパ-2-エン-1-オン
  • 1-{6-[(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)methyl]-5,7-dihydroxy-2,2-dimethyl-2H-chromen-8-yl}-3-phenylprop-2-en-1-one
Other name (2):
  • 3-Phenyl-1-[2,2-dimethyl-5,7-dihydroxy-6-(2,4,6-trihydroxy-5-methyl-3-acetylbenzyl)-2H-1-benzopyran-8-yl]-2-propene-1-one
  • 6-(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl)-2,2-dimethyl-8-(3-phenylpropenoyl)-2H-1-benzopyran-5,7-diol
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