Chem
J-GLOBAL ID:200907026709616748
Nikkaji number:J12.242D
Apoatropine
アポアトロピン
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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 H21 NO2
Molecular formula furigana:
C17-H21-N-O2
Molecular weight:
271.360
InChI:
InChI=1S/C17H21NO2/c1-12(13-6-4-3-5-7-13)17(19)20-16-10-14-8-9-15(11-16)18(14)2/h3-7,14-16H,1,8-11H2,2H3/t14-,15+,16?
InChI key:
WPUIZWXOSDVQJU-XYPWUTKMSA-N
SMILES:
CN1[C@H]2CC[C@@H]1CC(C2)OC(=O)C(=C)c1ccccc1
Systematic name (5):
α-メチレンベンゼン酢酸(1β,5β)-8-メチル-8-アザビシクロ[3.2.1]オクタン-3α-イル
アトロパ酸(1R,5S)-トロパン-3α-イル
α-メチレンベンゼン酢酸[(1R,5S)-8-メチル-8-アザビシクロ[3.2.1]オクタン-3α-イル]
(1R,5S)-8-メチル-8-アザビシクロ[3.2.1]オクタン-3-イル 2-フェニルプロパ-2-エノアート
(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 2-phenylprop-2-enoate
Other name (10):
アポアトロピン
Apoatropine
トロピンアトロパ酸エステル
Atropamin
Apoatropin
Atropamine
アトロパミン
α-Methylenebenzeneacetic acid [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3α-yl] ester
Atropic acid (1R,5S)-tropan-3α-yl ester
Tropine atropate ester
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CAS registry number:
500-55-0
Regulation number (2):
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