Chem
J-GLOBAL ID:201107037966623399   Nikkaji number:J2.961.796A

Xylaropyrone

キシラロピロン
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: C12H18O3
Molecular formula furigana: C12-H18-O3
Molecular weight: 210.273
InChI: InChI=1S/C12H18O3/c1-3-9(2)4-5-11-6-12(14)10(7-13)8-15-11/h6,8-9,13H,3-5,7H2,1-2H3/t9-/m1/s1
InChI key: INEAKDRHDBRKJD-SECBINFHSA-N
SMILES: CC[C@@H](C)CCc1cc(=O)c(CO)co1
Systematic name  (3):
  • 2-[(3R)-3-メチルペンチル]-5-(ヒドロキシメチル)-4H-ピラン-4-オン
  • 5-(ヒドロキシメチル)-2-[(3R)-3-メチルペンチル]-4H-ピラン-4-オン
  • 5-(hydroxymethyl)-2-[(3R)-3-methylpentyl]-4H-pyran-4-one
Other name (3):
  • 2-[(3R)-3-Methylpentyl]-5-(hydroxymethyl)-4H-pyran-4-one
  • キシラロピロン
  • Xylaropyrone
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