Chem
J-GLOBAL ID:200907024821349466   Nikkaji number:J2.583.710J

(3aα,3bβ,6aβ)-7aα-(1-Tosyl-1H-pyrrole-2-yl)decahydro-7H-cyclopenta[a]pentalene-7-one

(3aα,3bβ,6aβ)-7aα-(1-トシル-1H-ピロール-2-イル)デカヒドロ-7H-シクロペンタ[a]ペンタレン-7-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: C22H25NO3S
Molecular formula furigana: C22-H25-N-O3-S
Molecular weight: 383.510
InChI: InChI=1S/C22H25NO3S/c1-15-9-11-16(12-10-15)27(25,26)23-14-4-8-20(23)22-13-3-7-19(22)17-5-2-6-18(17)21(22)24/h4,8-12,14,17-19H,2-3,5-7,13H2,1H3/t17-,18+,19+,22+/m1/s1
InChI key: ULZSAWLSEATGDU-GHDARCQNSA-N
SMILES: Cc1ccc(cc1)S(=O)(=O)n1cccc1[C@]12CCC[C@H]1[C@@H]1CCC[C@@H]1C2=O
Systematic name  (3):
  • (3aα,3bβ,6aβ)-7aα-(1-トシル-1H-ピロール-2-イル)デカヒドロ-7H-シクロペンタ[a]ペンタレン-7-オン
  • (1S,2S,6S,8S)-6-[1-(4-メチルベンゼンスルホニル)-1H-ピロール-2-イル]トリシクロ[6.3.0.02,6]ウンデカン-7-オン
  • (1S,2S,6S,8S)-6-[1-(4-methylbenzenesulfonyl)-1H-pyrrol-2-yl]tricyclo[6.3.0.02,6]undecan-7-one
Other name (1):
  • (3aα,3bβ,6aβ)-7aα-(1-Tosyl-1H-pyrrole-2-yl)decahydro-7H-cyclopenta[a]pentalene-7-one
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