Chem
J-GLOBAL ID：200907038707199137   Nikkaji number：J2.280.350F

Xanthoangelol I

キサントアンゲロールI
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： C25H28O4
Molecular formula furigana： C25-H28-O4
Molecular weight： 392.495
InChI： InChI=1S/C25H28O4/c1-17(2)5-4-15-25(3)16-14-21-23(28)13-11-20(24(21)29-25)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28H,4,14-16H2,1-3H3
InChI key： AJTWDECGQXIMQX-UHFFFAOYSA-N
SMILES： CC(=CCCC1(C)CCc2c(O)ccc(C(=O)C=Cc3ccc(O)cc3)c2O1)C
Systematic name  (3)：
  • 1-[2,3-ジヒドロ-5-ヒドロキシ-2-メチル-2-(4-メチル-3-ペンテニル)-4H-1-ベンゾピラン-8-イル]-3-(4-ヒドロキシフェニル)-2-プロペン-1-オン
  • 1-[5-ヒドロキシ-2-メチル-2-(4-メチルペンタ-3-エン-1-イル)-3,4-ジヒドロ-2H-1-ベンゾピラン-8-イル]-3-(4-ヒドロキシフェニル)プロパ-2-エン-1-オン
  • 1-[5-hydroxy-2-methyl-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-2H-1-benzopyran-8-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Other name (3)：
  • 1-[2,3-Dihydro-5-hydroxy-2-methyl-2-(4-methyl-3-pentenyl)-4H-1-benzopyran-8-yl]-3-(4-hydroxyphenyl)-2-propene-1-one
  • キサントアンゲロールI
  • Xanthoangelol I
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