Chem
J-GLOBAL ID：200907023519346818   Nikkaji number：J1.809.629C

(1β,5β)-4β,6-Bis(hydroxymethyl)-7-ethyl-2-oxabicyclo[3.3.0]octane-6-ene-3-one

(1β,5β)-4β,6-ビス(ヒドロキシメチル)-7-エチル-2-オキサビシクロ[3.3.0]オクタン-6-エン-3-オン
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： C11H16O4
Molecular formula furigana： C11-H16-O4
Molecular weight： 212.245
InChI： InChI=1S/C11H16O4/c1-2-6-3-9-10(7(6)4-12)8(5-13)11(14)15-9/h8-10,12-13H,2-5H2,1H3/t8-,9-,10-/m0/s1
InChI key： KFVNUJQBYLMFIA-GUBZILKMSA-N
SMILES： CCC1=C(CO)[C@@H]2[C@H](C1)OC(=O)[C@H]2CO
Systematic name  (3)：
  • (1β,5β)-4β,6-ビス(ヒドロキシメチル)-7-エチル-2-オキサビシクロ[3.3.0]オクタン-6-エン-3-オン
  • (3R,3aR,6aS)-5-エチル-3,4-ビス(ヒドロキシメチル)-2H,3H,3aH,6H,6aH-シクロペンタ[b]フラン-2-オン
  • (3R,3aR,6aS)-5-ethyl-3,4-bis(hydroxymethyl)-2H,3H,3aH,6H,6aH-cyclopenta[b]furan-2-one
Other name (1)：
  • (1β,5β)-4β,6-Bis(hydroxymethyl)-7-ethyl-2-oxabicyclo[3.3.0]octane-6-ene-3-one
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