Chem
J-GLOBAL ID:200907053248961135
Nikkaji number:J1.474.828H
Methyl-homatropine
メチル-ホマトロピン
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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:
C17 H24 [N+]O3
Molecular formula furigana:
C17-H24-N-O3
Molecular weight:
290.382
InChI:
InChI=1S/C17H24NO3/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12/h3-7,13-16,19H,8-11H2,1-2H3/q+1/t13-,14+,15+,16?
InChI key:
WKWOJBUWWZTUQV-SPUOUPEWSA-N
SMILES:
C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)c1ccccc1
Systematic name (4):
(1β,5β)-3α-(ヒドロキシフェニルアセチルオキシ)-8,8-ジメチル-8-アゾニアビシクロ[3.2.1]オクタン
(1β,5β)-8,8-ジメチル-8-アゾニアビシクロ[3.2.1]オクタン-3α-オールヒドロキシ(フェニル)アセタート
(1R,3R,5S)-3-[(2-ヒドロキシ-2-フェニルアセチル)オキシ]-8,8-ジメチル-8-アザビシクロ[3.2.1]オクタン-8-イウム
(1R,3R,5S)-3-[(2-hydroxy-2-phenylacetyl)oxy]-8,8-dimethyl-8-azabicyclo[3.2.1]octan-8-ium
Other name (4):
(1β,5β)-3α-(Hydroxyphenylacetyloxy)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane
(1β,5β)-8,8-Dimethyl-8-azoniabicyclo[3.2.1]octane-3α-ol hydroxy(phenyl)acetate
メチル-ホマトロピン
Methyl-homatropine
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