Chem
J-GLOBAL ID：200907062767584941
Nikkaji number：J12.566K
Bergaptol
ベルガプトール
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
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
Molecular formula： C11H6O4
Molecular formula furigana： C11-H6-O4
Molecular weight： 202.165
InChI：
InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H
InChI key：
GIJHDGJRTUSBJR-UHFFFAOYSA-N
SMILES：
Oc1c2ccoc2cc2oc(=O)ccc12
Systematic name (3)：
- 4-ヒドロキシ-7H-フロ[3,2-g][1]ベンゾピラン-7-オン
- 4-ヒドロキシ-7H-フロ[3,2-g]クロメン-7-オン
- 4-hydroxy-7H-furo[3,2-g]chromen-7-one
- ベルガプトール
- Bergaptol
- 4-Hydroxy-7H-furo[3,2-g][1]benzopyran-7-one
- 5-ヒドロキシプソラレン
- 5-Hydroxypsoralen
KEGG COMPOUND：
C00758
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