Chem
J-GLOBAL ID：200907049516611226   Nikkaji number：J2.771.419F

N-(p-Hydroxyphenethyl)actinidine

N-(p-ヒドロキシフェネチル)アクチニジン
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： C18H22[N+]O
Molecular formula furigana： C18-H22-N-O
Molecular weight： 268.379
InChI： InChI=1S/C18H21NO/c1-13-3-8-17-14(2)11-19(12-18(13)17)10-9-15-4-6-16(20)7-5-15/h4-7,11-13H,3,8-10H2,1-2H3/p+1/t13-/m0/s1
InChI key： CKHCFVWFFIHGMT-ZDUSSCGKSA-O
SMILES： C[C@H]1CCc2c1c[n+](CCc1ccc(O)cc1)cc2C
Systematic name  (3)：
  • (7S)-6,7-ジヒドロ-2-[2-(4-ヒドロキシフェニル)エチル]-4,7-ジメチル-5H-シクロペンタ[c]ピリジン-2-イウム
  • (7S)-2-[2-(4-ヒドロキシフェニル)エチル]-4,7-ジメチル-5H,6H,7H-シクロペンタ[c]ピリジン-2-イウム
  • (7S)-2-[2-(4-hydroxyphenyl)ethyl]-4,7-dimethyl-5H,6H,7H-cyclopenta[c]pyridin-2-ium
Other name (3)：
  • (7S)-6,7-Dihydro-2-[2-(4-hydroxyphenyl)ethyl]-4,7-dimethyl-5H-cyclopenta[c]pyridine-2-ium
  • N-(p-Hydroxyphenethyl)actinidine
  • N-(p-ヒドロキシフェネチル)アクチニジン
CAS registry number： 15794-92-0
KEGG COMPOUND： C09984
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