Chem
J-GLOBAL ID：200907003371582451   Nikkaji number：J17.517J

Deoxypatulinic acid

デオキシパツリン酸
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： C7H8O4
Molecular formula furigana： C7-H8-O4
Molecular weight： 156.137
InChI： InChI=1S/C7H8O4/c8-6-1-2-11-4-5(6)3-7(9)10/h4H,1-3H2,(H,9,10)
InChI key： NDEBBGKFXQDNLC-UHFFFAOYSA-N
SMILES： OC(=O)CC1=COCCC1=O
Systematic name  (4)：
  • 3,4-ジヒドロ-4-オキソ-2H-ピラン-5-酢酸
  • 4-オキソ-5,6-ジヒドロ-4H-ピラン-3-酢酸
  • 2-(4-オキソ-3,4-ジヒドロ-2H-ピラン-5-イル)酢酸
  • 2-(4-oxo-3,4-dihydro-2H-pyran-5-yl)acetic acid
Other name (4)：
  • デオキシパツリン酸
  • Deoxypatulinic acid
  • 3,4-Dihydro-4-oxo-2H-pyran-5-acetic acid
  • 4-Oxo-5,6-dihydro-4H-pyran-3-acetic acid
CAS registry number： 39115-30-5
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