基本情報
- CAS
7553-53-9- 標準SMILES
COc1cc(CNC(=O)CCCCC=CC(C)C)ccc1O- InChIKey
YKPUWZUDDOIDPM-UHFFFAOYSA-N- 分子式
- C18H27NO3
- 平均分子量
- 305.4 g/mol
- 単同位体質量
- 305.19909372
概要
N-[(4-Hydroxy-3-methoxyphenyl)methyl]-8-methyl-6-nonenamide has been reported in Capsicum pubescens, Capsicum annuum, and Capsicum with data available.
名称と識別子
- 優先名称
- N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methylnon-6-enamide
- IUPAC
- N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide
- 現地名
- カプサイシン (E/Z-混合物)
- 英語名
- Capsaicin (E/Z-Mixture)
- 分子式
- C18H27NO3
- 分子量
- 305.41
名称と別名
N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide7553-53-9DTXSID40859357N-((4-hydroxy-3-methoxyphenyl)methyl)-8-methylnon-6-enamideRefChem:1090695DTXCID60809718CAPSAICIN, NATURALN-[(4-Hydroxy-3-methoxyphenyl)methyl]-8-methyl-6-nonenamide6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-, (6Z)-Zucapsaicin;Civamide;cis-CapsaicinMFCD000172598-Methyl-N-vanillyl-trans-6-nonenamide
名称をさらに表示
カプサイシン (E/Z-混合物)(E/Z)-8-Methyl-N-vanillyl-6-nonenaMideN-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide6-Nonenamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methyl-Capsaicin-D3 (E/Z-Mixture)Q: What is Capsaicin-D3 (E/Z-Mixture) Q: What is the CAS Number of Capsaicin-D3 (E/Z-Mixture) Q: What is the storage condition of Capsaicin-D3 (E/Z-Mixture) Q: What are the applications of Capsaicin-D3 (E/Z-Mixture)
Capsaicin(Vanilloid)Spectrum_000303Prestwick0_000879Prestwick1_000879Spectrum2_000770Spectrum3_001449Spectrum4_001739Capsaicin (E/Z-Mixture)
物性
構造計算による物性
- XLogP
- 3.6
- 極性表面積
- 58.6 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 3
- 回転可能結合数
- 9
- 重原子数
- 22
- 形式電荷
- 0
- 複雑度
- 341
物理化学的性質
- 融点
- 60 · 60-620C
- 沸点
- 511.5 · 511.5±50.0 °C(Predicted)
- 比重(密度)
- 1.041 · 1.041±0.06 g/cm3(Predicted)
- 貯蔵温度
- -20 °C · -20°C Freezer, Under Inert Atmosphere
- 酸解離定数(Pka)
- 9.76 · 9.76±0.20(Predicted)
化学的性質
化学的特性Capsaicin(E/Z-Mixture) is Off-White Solid
化学と産業
応用分野
使用Capsaicin(E/Z-Mixture) is a representative lot is a 5:1 E:Z mixture. Has been isolated from paprika and cayenne. It is used as a tool in neurobiological research. Prototype vanilloid receptor agonist. Topical analgesic.
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関連反応
3 件
化合物ノート
読み込み中…