Chem
J-GLOBAL ID:200907087541022854
Nikkaji number:J1.962.139A
CP-481715
N-[(1S,2S,4R)-4-カルバモイル-1-(3-フルオロベンジル)-2,7-ジヒドロキシ-7-メチルオクチル]キノキサリン-2-カルボアミド
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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:
C26 H31 FN4 O4
Molecular formula furigana:
C26-H31-F-N4-O4
Molecular weight:
482.556
InChI:
InChI=1S/C26H31FN4O4/c1-26(2,35)11-10-17(24(28)33)14-23(32)21(13-16-6-5-7-18(27)12-16)31-25(34)22-15-29-19-8-3-4-9-20(19)30-22/h3-9,12,15,17,21,23,32,35H,10-11,13-14H2,1-2H3,(H2,28,33)(H,31,34)/t17-,21+,23+/m1/s1
InChI key:
YEQJVHQCUDMXFG-FHZYATBESA-N
SMILES:
CC(C)(O)CC[C@H](C[C@H](O)[C@H](Cc1cccc(F)c1)NC(=O)c1cnc2ccccc2n1)C(=O)N
Systematic name (3):
N-[(1S,2S,4R)-4-カルバモイル-1-(3-フルオロベンジル)-2,7-ジヒドロキシ-7-メチルオクチル]キノキサリン-2-カルボアミド
(2R,4S,5S)-6-(3-フルオロフェニル)-4-ヒドロキシ-2-(3-ヒドロキシ-3-メチルブチル)-5-[(キノキサリン-2-イル)ホルムアミド]ヘキサンアミド
(2R,4S,5S)-6-(3-fluorophenyl)-4-hydroxy-2-(3-hydroxy-3-methylbutyl)-5-[(quinoxalin-2-yl)formamido]hexanamide
Other name (2):
N-[(1S,2S,4R)-4-Carbamoyl-1-(3-fluorobenzyl)-2,7-dihydroxy-7-methyloctyl]quinoxaline-2-carboxamide
CP-481715
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