Chem
J-GLOBAL ID：201207081472648638   Nikkaji number：J3.112.767J

Nakijinamine F

ナキジナミンF
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： C29H33BrN4[N+]O2
Molecular formula furigana： C29-H33-BR-N5-O2
Molecular weight： 563.519
InChI： InChI=1S/C29H32BrN5O2/c1-16(2)12-24(36)34-28-27-26-19(8-10-31-22(26)9-11-32-27)25(29(28)37)21(15-35(3,4)5)20-14-33-23-13-17(30)6-7-18(20)23/h6-11,13-14,16,21,33H,12,15H2,1-5H3,(H2-,31,32,34,36,37)/p+1
InChI key： GHEDHSSHHYTUKL-UHFFFAOYSA-O
SMILES： CC(C)CC(=O)Nc1c(O)c(C(C[N+](C)(C)C)c2c[nH]c3cc(Br)ccc23)c2ccnc3cc[nH]c1c23
Systematic name  (3)：
  • トリメチル[2-(8-ヒドロキシ-9-[(3-メチルブタノイル)アミノ]-1H-ベンゾ[de][1,6]ナフチリジン-7-イル)-2-(6-ブロモ-1H-インドール-3-イル)エチル]アミニウム
  • [2-(6-ブロモ-1H-インドール-3-イル)-2-[11-ヒドロキシ-12-(3-メチルブタンアミド)-2,6-ジアザトリシクロ[7.3.1.05,13]トリデカ-1(13),3,5,7,9,11-ヘキサエン-10-イル]エチル]トリメチルアザニウム
  • [2-(6-bromo-1H-indol-3-yl)-2-[11-hydroxy-12-(3-methylbutanamido)-2,6-diazatricyclo[7.3.1.05,13]trideca-1(13),3,5,7,9,11-hexaen-10-yl]ethyl]trimethylazanium
Other name (3)：
  • Trimethyl[2-(8-hydroxy-9-[(3-methylbutanoyl)amino]-1H-benzo[de][1,6]naphthyridine-7-yl)-2-(6-bromo-1H-indole-3-yl)ethyl]aminium
  • ナキジナミンF
  • Nakijinamine F
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