Chem
J-GLOBAL ID：200907067743714471   Nikkaji number：J2.169.965I

Ocellapyrone A

オセラピロンA
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： C22H30O3
Molecular formula furigana： C22-H30-O3
Molecular weight： 342.479
InChI： InChI=1S/C22H30O3/c1-9-16-21(6)11-12(2)10-13(3)18(21)22(16,7)19-14(4)17(23)15(5)20(24-8)25-19/h10-11,16,18H,9H2,1-8H3/t16-,18+,21+,22+/m1/s1
InChI key： IQPZJQHBDGXCCK-QQOZLPODSA-N
SMILES： CC[C@@H]1[C@]2(C)C=C(C)C=C(C)[C@@H]2[C@@]1(C)c1oc(OC)c(C)c(=O)c1C
Systematic name  (4)：
  • 2-メトキシ-3,5-ジメチル-6-[(6β)-1β,3,5,7-テトラメチル-8α-エチルビシクロ[4.2.0]オクタ-2,4-ジエン-7β-イル]-4H-ピラン-4-オン
  • 2-[(1S,6S)-1β,3,5,7-テトラメチル-8α-エチルビシクロ[4.2.0]オクタ-2,4-ジエン-7β-イル]-3,5-ジメチル-6-メトキシ-4H-ピラン-4-オン
  • 2-[(1S,6S,7S,8R)-8-エチル-1,3,5,7-テトラメチルビシクロ[4.2.0]オクタ-2,4-ジエン-7-イル]-6-メトキシ-3,5-ジメチル-4H-ピラン-4-オン
  • 2-[(1S,6S,7S,8R)-8-ethyl-1,3,5,7-tetramethylbicyclo[4.2.0]octa-2,4-dien-7-yl]-6-methoxy-3,5-dimethyl-4H-pyran-4-one
Other name (4)：
  • 2-Methoxy-3,5-dimethyl-6-[(6β)-1β,3,5,7-tetramethyl-8α-ethylbicyclo[4.2.0]octa-2,4-diene-7β-yl]-4H-pyran-4-one
  • 2-[(1S,6S)-1β,3,5,7-Tetramethyl-8α-ethylbicyclo[4.2.0]octa-2,4-diene-7β-yl]-3,5-dimethyl-6-methoxy-4H-pyran-4-one
  • オセラピロンA
  • Ocellapyrone A
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