Chem
J-GLOBAL ID：201207097315398370   Nikkaji number：J3.041.976F

(9S)-3-[2-[4-(6-Fluoro-1,2-benzoisoxazole-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-9-(palmitoyloxy)-4H-pyrido[1,2-a]pyrimidine-4-one

(9S)-3-{2-[4-(6-フルオロ-1,2-ベンゾオキサゾール-3-イル)ピペリジン-1-イル]エチル}-2-メチル-4-オキソ-4H,6H,7H,8H,9H-ピリド[1,2-a]ピリミジン-9-イル ヘキサデカノアート
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： C39H57FN4O4
Molecular formula furigana： C39-H57-F-N4-O4
Molecular weight： 664.907
InChI： InChI=1S/C39H57FN4O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-36(45)47-34-17-16-24-44-38(34)41-29(2)32(39(44)46)23-27-43-25-21-30(22-26-43)37-33-20-19-31(40)28-35(33)48-42-37/h19-20,28,30,34H,3-18,21-27H2,1-2H3/t34-/m0/s1
InChI key： VOMKSBFLAZZBOW-UMSFTDKQSA-N
SMILES： CCCCCCCCCCCCCCCC(=O)O[C@H]1CCCn2c1nc(C)c(CCN1CCC(CC1)c1noc3cc(F)ccc13)c2=O
Systematic name  (3)：
  • (9S)-3-[2-[4-(6-フルオロ-1,2-ベンゾイソオキサゾール-3-イル)-1-ピペリジニル]エチル]-6,7,8,9-テトラヒドロ-2-メチル-9-(パルミトイルオキシ)-4H-ピリド[1,2-a]ピリミジン-4-オン
  • (9S)-3-{2-[4-(6-フルオロ-1,2-ベンゾオキサゾール-3-イル)ピペリジン-1-イル]エチル}-2-メチル-4-オキソ-4H,6H,7H,8H,9H-ピリド[1,2-a]ピリミジン-9-イル ヘキサデカノアート
  • (9S)-3-{2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl}-2-methyl-4-oxo-4H,6H,7H,8H,9H-pyrido[1,2-a]pyrimidin-9-yl hexadecanoate
Other name (1)：
  • (9S)-3-[2-[4-(6-Fluoro-1,2-benzoisoxazole-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-9-(palmitoyloxy)-4H-pyrido[1,2-a]pyrimidine-4-one
Thsaurus map：
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