Chem
J-GLOBAL ID：200907013459052059   Nikkaji number：J1.580.310J

Aethione

エチオン
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： C14H22O2
Molecular formula furigana： C14-H22-O2
Molecular weight： 222.328
InChI： InChI=1S/C14H22O2/c1-9(2)11-4-5-14(8-11)10(3)6-12(15)7-13(14)16/h10-12,15H,1,4-8H2,2-3H3/t10-,11-,12+,14+/m1/s1
InChI key： QTEDQRZZLSNTKM-NMKXLXIOSA-N
SMILES： C[C@@H]1C[C@H](O)CC(=O)[C@@]21CC[C@H](C2)C(=C)C
Systematic name  (3)：
  • (2R,5S)-8β-ヒドロキシ-10β-メチル-2α-イソプロペニルスピロ[4.5]デカン-6-オン
  • (2R,5S,8S,10R)-8-ヒドロキシ-10-メチル-2-(プロパ-1-エン-2-イル)スピロ[4.5]デカン-6-オン
  • (2R,5S,8S,10R)-8-hydroxy-10-methyl-2-(prop-1-en-2-yl)spiro[4.5]decan-6-one
Other name (3)：
  • (2R,5S)-8β-Hydroxy-10β-methyl-2α-isopropenylspiro[4.5]decane-6-one
  • エチオン
  • Aethione
CAS registry number： 349106-28-1
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