Chem
J-GLOBAL ID：200907093079275350   Nikkaji number：J15.094K

α-Cyclocostunolide

α-シクロコスツノリド
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： C15H20O2
Molecular formula furigana： C15-H20-O2
Molecular weight： 232.323
InChI： InChI=1S/C15H20O2/c1-9-5-4-7-15(3)8-6-11-10(2)14(16)17-13(11)12(9)15/h5,11-13H,2,4,6-8H2,1,3H3/t11-,12+,13-,15+/m0/s1
InChI key： UHODXTMZSDNATP-SFDCQRBFSA-N
SMILES： CC1=CCC[C@]2(C)CC[C@@H]3[C@H](OC(=O)C3=C)[C@@H]12
Systematic name  (4)：
  • (3aS,9aβ,9bα)-3-メチレン-5aα,9-ジメチル-3a,4,5,5a,6,7,9a,9b-オクタヒドロナフト[1,2-b]フラン-2(3H)-オン
  • (3aS)-3a,4,5,5a,6,7,9aβ,9bα-オクタヒドロ-5aα,9-ジメチル-3-メチレンナフト[1,2-b]フラン-2(3H)-オン
  • (3aS,5aR,9aR,9bS)-5a,9-ジメチル-3-メチリデン-2H,3H,3aH,4H,5H,5aH,6H,7H,9aH,9bH-ナフト[1,2-b]フラン-2-オン
  • (3aS,5aR,9aR,9bS)-5a,9-dimethyl-3-methylidene-2H,3H,3aH,4H,5H,5aH,6H,7H,9aH,9bH-naphtho[1,2-b]furan-2-one
Other name (3)：
  • α-シクロコスツノリド
  • α-Cyclocostunolide
  • (3aS)-3a,4,5,5a,6,7,9aβ,9bα-Octahydro-5aα,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
CAS registry number： 2221-81-0
KEGG COMPOUND： C09383
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