Chem
J-GLOBAL ID：200907099141762822
Nikkaji number：J2.324.849B
(2S)-2′,8a′α-Dimethyl-6-(3-pyridinyl)-4a′β,5′,6′,7′,8′,8a′-hexahydrospiro[4H-furo[3,2-c]pyran-2(3H),1′(4′H)-naphthalene]-4-one
(2S)-2′,8a′α-ジメチル-6-(3-ピリジニル)-4a′β,5′,6′,7′,8′,8a′-ヘキサヒドロスピロ[4H-フロ[3,2-c]ピラン-2(3H),1′(4′H)-ナフタレン]-4-オン
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
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
Molecular formula： C23H25NO3
Molecular formula furigana： C23-H25-N-O3
Molecular weight： 363.457
InChI：
InChI=1S/C23H25NO3/c1-15-8-9-17-7-3-4-10-22(17,2)23(15)13-18-20(27-23)12-19(26-21(18)25)16-6-5-11-24-14-16/h5-6,8,11-12,14,17H,3-4,7,9-10,13H2,1-2H3/t17-,22+,23-/m0/s1
InChI key：
WMKNULKAYQNFRM-IMRHEYAYSA-N
SMILES：
CC1=CC[C@@H]2CCCC[C@@]2(C)[C@@]21Cc1c(O2)cc(oc1=O)c1cccnc1
Systematic name (3)：
- (2S)-2′,8a′α-ジメチル-6-(3-ピリジニル)-4a′β,5′,6′,7′,8′,8a′-ヘキサヒドロスピロ[4H-フロ[3,2-c]ピラン-2(3H),1′(4′H)-ナフタレン]-4-オン
- (2S,4'aS,8'aR)-2',8'a-ジメチル-6-(ピリジン-3-イル)-3,4,4'a,5',6',7',8',8'a-オクタヒドロ-4'H-スピロ[フロ[3,2-c]ピラン-2,1'-ナフタレン]-4-オン
- (2S,4'aS,8'aR)-2',8'a-dimethyl-6-(pyridin-3-yl)-3,4,4'a,5',6',7',8',8'a-octahydro-4'H-spiro[furo[3,2-c]pyran-2,1'-naphthalen]-4-one
- (2S)-2′,8a′α-Dimethyl-6-(3-pyridinyl)-4a′β,5′,6′,7′,8′,8a′-hexahydrospiro[4H-furo[3,2-c]pyran-2(3H),1′(4′H)-naphthalene]-4-one
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