Chem
J-GLOBAL ID：200907033198559704   Nikkaji number：J2.496.477I

Penicillone

ペニシロン
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： C11H14O4S
Molecular formula furigana： C11-H14-O4-S
Molecular weight： 242.290
InChI： InChI=1S/C11H14O4S/c1-6(16)4-8(12)11-7(2)9(14-3)5-10(13)15-11/h5-6,16H,4H2,1-3H3
InChI key： ZOBPOAOLLNMERS-UHFFFAOYSA-N
SMILES： COc1cc(=O)oc(C(=O)CC(C)S)c1C
Systematic name  (3)：
  • 4-メトキシ-5-メチル-6-(3-メルカプトブタノイル)-2H-ピラン-2-オン
  • 4-メトキシ-5-メチル-6-(3-スルファニルブタノイル)-2H-ピラン-2-オン
  • 4-methoxy-5-methyl-6-(3-sulfanylbutanoyl)-2H-pyran-2-one
Other name (3)：
  • 4-Methoxy-5-methyl-6-(3-mercaptobutanoyl)-2H-pyran-2-one
  • ペニシロン
  • Penicillone
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