Chem
J-GLOBAL ID:200907016912490924   Nikkaji number:J1.983.820J

(3a′S,6a′R,13S)-2′-Methyl-5′-[2-(phenylsulfonyl)ethyl]-4′,5′,6′,6a′-tetrahydrospiro[tricyclo[7.3.1.02,7]tridecane-13,3′(3a′H)-[2H]pyrrolo[3,4-d]isoxazole]-2(7),3,5,10-tetrene-4′,6′-dione

(3S,3aS,6aR)-5-[2-(ベンゼンスルホニル)エチル]-2-メチル-2,3a,4,5,6,6a-ヘキサヒドロスピロ[ピロロ[3,4-d][1,2]オキサゾール-3,13'-トリシクロ[7.3.1.02,7]トリデカン]-2',4',6',10'-テトラエン-4,6-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: C26H26N2O5S
Molecular formula furigana: C26-H26-N2-O5-S
Molecular weight: 478.560
InChI: InChI=1S/C26H26N2O5S/c1-27-26(18-9-7-13-21(26)20-12-6-5-8-17(20)16-18)22-23(33-27)25(30)28(24(22)29)14-15-34(31,32)19-10-3-2-4-11-19/h2-12,18,21-23H,13-16H2,1H3/t18?,21?,22-,23+,26-/m0/s1
InChI key: AHXYRULZHCDSDP-INOJOROKSA-N
SMILES: CN1O[C@@H]2[C@@H](C(=O)N(CCS(=O)(=O)c3ccccc3)C2=O)[C@]21C1Cc3ccccc3C2CC=C1
Systematic name  (3):
  • (3a′S,6a′R,13S)-2′-メチル-5′-[2-(フェニルスルホニル)エチル]-4′,5′,6′,6a′-テトラヒドロスピロ[トリシクロ[7.3.1.02,7]トリデカン-13,3′(3a′H)-[2H]ピロロ[3,4-d]イソオキサゾール]-2(7),3,5,10-テトラエン-4′,6′-ジオン
  • (3S,3aS,6aR)-5-[2-(ベンゼンスルホニル)エチル]-2-メチル-2,3a,4,5,6,6a-ヘキサヒドロスピロ[ピロロ[3,4-d][1,2]オキサゾール-3,13'-トリシクロ[7.3.1.02,7]トリデカン]-2',4',6',10'-テトラエン-4,6-ジオン
  • (3S,3aS,6aR)-5-[2-(benzenesulfonyl)ethyl]-2-methyl-2,3a,4,5,6,6a-hexahydrospiro[pyrrolo[3,4-d][1,2]oxazole-3,13'-tricyclo[7.3.1.02,7]tridecane]-2',4',6',10'-tetraene-4,6-dione
Other name (1):
  • (3a′S,6a′R,13S)-2′-Methyl-5′-[2-(phenylsulfonyl)ethyl]-4′,5′,6′,6a′-tetrahydrospiro[tricyclo[7.3.1.02,7]tridecane-13,3′(3a′H)-[2H]pyrrolo[3,4-d]isoxazole]-2(7),3,5,10-tetrene-4′,6′-dione
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