Chem
J-GLOBAL ID：201207032210053594
Nikkaji number：J3.066.543K
Nα-(2-Hydroxybenzoyl)-N-(2-hydroxyphenyl)-4-[3,5-bis(trifluoromethyl)phenylazo]-L-phenylalaninamide
Nα-(2-ヒドロキシベンゾイル)-N-(2-ヒドロキシフェニル)-4-[3,5-ビス(トリフルオロメチル)フェニルアゾ]-L-フェニルアラニンアミド
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
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
Molecular formula： C30H22F6N4O4
Molecular formula furigana： C30-H22-F6-N4-O4
Molecular weight： 616.520
InChI：
InChI=1S/C30H22F6N4O4/c31-29(32,33)18-14-19(30(34,35)36)16-21(15-18)40-39-20-11-9-17(10-12-20)13-24(28(44)37-23-6-2-4-8-26(23)42)38-27(43)22-5-1-3-7-25(22)41/h1-12,14-16,24,41-42H,13H2,(H,37,44)(H,38,43)/t24-/m0/s1
InChI key：
DIEWHROQYASNFR-DEOSSOPVSA-N
SMILES：
Oc1ccccc1NC(=O)[C@H](Cc1ccc(cc1)N=Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)NC(=O)c1ccccc1O
Systematic name (3)：
- Nα-(2-ヒドロキシベンゾイル)-N-(2-ヒドロキシフェニル)-4-[3,5-ビス(トリフルオロメチル)フェニルアゾ]-L-フェニルアラニンアミド
- (2S)-3-(4-{2-[3,5-ビス(トリフルオロメチル)フェニル]ジアゼン-1-イル}フェニル)-N-(2-ヒドロキシフェニル)-2-[(2-ヒドロキシフェニル)ホルムアミド]プロパンアミド
- (2S)-3-(4-{2-[3,5-bis(trifluoromethyl)phenyl]diazen-1-yl}phenyl)-N-(2-hydroxyphenyl)-2-[(2-hydroxyphenyl)formamido]propanamide
- Nα-(2-Hydroxybenzoyl)-N-(2-hydroxyphenyl)-4-[3,5-bis(trifluoromethyl)phenylazo]-L-phenylalaninamide
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