Chem
J-GLOBAL ID：200907048451589515   Nikkaji number：J1.627.947A

3α-Hydroxy-9,20-cyclo-9,10-secoabieta-1,5,8,10(20),13-pentene-7,11,12-trione

3α-ヒドロキシ-9,20-シクロ-9,10-セコアビエタ-1,5,8,10(20),13-ペンタエン-7,11,12-トリオン
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： C20H20O4
Molecular formula furigana： C20-H20-O4
Molecular weight： 324.376
InChI： InChI=1S/C20H20O4/c1-10(2)12-8-13-14(19(24)18(12)23)7-11-5-6-17(22)20(3,4)15(11)9-16(13)21/h5-10,17,22H,1-4H3/t17-/m1/s1
InChI key： KFQHZZINOYUPEI-QGZVFWFLSA-N
SMILES： CC(C)C1=Cc2c(cc3C=C[C@@H](O)C(C)(C)c3cc2=O)C(=O)C1=O
Systematic name  (4)：
  • (8R)-2-イソプロピル-8-ヒドロキシ-8,9-ジヒドロ-9,9-ジメチル-11H-ジベンゾ[a,d]シクロヘプテン-3,4,11-トリオン
  • 3α-ヒドロキシ-9,20-シクロ-9,10-セコアビエタ-1,5,8,10(20),13-ペンタエン-7,11,12-トリオン
  • (13R)-13-ヒドロキシ-12,12-ジメチル-6-(プロパン-2-イル)トリシクロ[9.4.0.03,8]ペンタデカ-1,3(8),6,10,14-ペンタエン-4,5,9-トリオン
  • (13R)-13-hydroxy-12,12-dimethyl-6-(propan-2-yl)tricyclo[9.4.0.03,8]pentadeca-1,3(8),6,10,14-pentaene-4,5,9-trione
Other name (2)：
  • (8R)-2-Isopropyl-8-hydroxy-8,9-dihydro-9,9-dimethyl-11H-dibenzo[a,d]cycloheptene-3,4,11-trione
  • 3α-Hydroxy-9,20-cyclo-9,10-secoabieta-1,5,8,10(20),13-pentene-7,11,12-trione
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