Chem
J-GLOBAL ID:200907029223110850   Nikkaji number:J1.450.043J

(8aS)-1β,6α-Dimethyl-7-butyl-3,3aα,5aβ,6-tetrahydrocyclopenta[c]pentalene-2,5(1H,4H)-dione

(1S,2R,5S,8R,9S)-10-ブチル-2,9-ジメチルトリシクロ[6.3.0.01,5]ウンデカ-10-エン-3,7-ジオン
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: C17H24O2
Molecular formula furigana: C17-H24-O2
Molecular weight: 260.377
InChI: InChI=1S/C17H24O2/c1-4-5-6-12-9-17-11(3)14(18)7-13(17)8-15(19)16(17)10(12)2/h9-11,13,16H,4-8H2,1-3H3/t10-,11+,13+,16+,17+/m1/s1
InChI key: SUTSADKYRIQLPL-CIOHAFIYSA-N
SMILES: CCCCC1=C[C@]23[C@@H](C)C(=O)C[C@H]2CC(=O)[C@@H]3[C@@H]1C
Systematic name  (3):
  • (8aS)-1β,6α-ジメチル-7-ブチル-3,3aα,5aβ,6-テトラヒドロシクロペンタ[c]ペンタレン-2,5(1H,4H)-ジオン
  • (1S,2R,5S,8R,9S)-10-ブチル-2,9-ジメチルトリシクロ[6.3.0.01,5]ウンデカ-10-エン-3,7-ジオン
  • (1S,2R,5S,8R,9S)-10-butyl-2,9-dimethyltricyclo[6.3.0.01,5]undec-10-ene-3,7-dione
Other name (1):
  • (8aS)-1β,6α-Dimethyl-7-butyl-3,3aα,5aβ,6-tetrahydrocyclopenta[c]pentalene-2,5(1H,4H)-dione
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