Chem
J-GLOBAL ID:200907071638998577
Nikkaji number:J2.772.766B
(1α,4α)-5β,6β-Epoxy-7-oxabicyclo[2.2.1]heptane-2β-carboxylic acid 2-oxo-2-(dimethylamino)ethyl ester
(1α,4α)-5β,6β-エポキシ-7-オキサビシクロ[2.2.1]ヘプタン-2β-カルボン酸2-オキソ-2-(ジメチルアミノ)エチル
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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:
C11 H15 NO5
Molecular formula furigana:
C11-H15-N-O5
Molecular weight:
241.243
InChI:
InChI=1S/C11H15NO5/c1-12(2)7(13)4-15-11(14)5-3-6-9-10(17-9)8(5)16-6/h5-6,8-10H,3-4H2,1-2H3/t5-,6-,8+,9+,10-/m0/s1
InChI key:
FXBPKIBVZSNHPK-UWVAYFGMSA-N
SMILES:
CN(C)C(=O)COC(=O)[C@H]1C[C@@H]2O[C@H]1[C@@H]1O[C@H]21
Systematic name (3):
(1α,4α)-5β,6β-エポキシ-7-オキサビシクロ[2.2.1]ヘプタン-2β-カルボン酸2-オキソ-2-(ジメチルアミノ)エチル
(ジメチルカルバモイル)メチル (1S,2R,4S,5R,6S)-3,8-ジオキサトリシクロ[3.2.1.02,4 ]オクタン-6-カルボキシラート
(dimethylcarbamoyl)methyl (1S,2R,4S,5R,6S)-3,8-dioxatricyclo[3.2.1.02,4 ]octane-6-carboxylate
Other name (1):
(1α,4α)-5β,6β-Epoxy-7-oxabicyclo[2.2.1]heptane-2β-carboxylic acid 2-oxo-2-(dimethylamino)ethyl ester
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