Chem
J-GLOBAL ID：200907055598703581   Nikkaji number：J250.623H

3-[[1,3-Dioxo-3-[3-[(1-oxooctadecyl)amino]phenyl]propyl]amino]-4-methoxybenzenesulfonic acid

4-メトキシ-3-[3-(3-オクタデカンアミドフェニル)-3-オキソプロパンアミド]ベンゼン-1-スルホン酸
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： C34H50N2O7S
Molecular formula furigana： C34-H50-N2-O7-S
Molecular weight： 630.840
InChI： InChI=1S/C34H50N2O7S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-33(38)35-28-20-18-19-27(24-28)31(37)26-34(39)36-30-25-29(44(40,41)42)22-23-32(30)43-2/h18-20,22-25H,3-17,21,26H2,1-2H3,(H,35,38)(H,36,39)(H,40,41,42)
InChI key： WBRNAYOLDDFLPV-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCCCC(=O)Nc1cccc(c1)C(=O)CC(=O)Nc1cc(ccc1OC)S(=O)(=O)O
Systematic name  (3)：
  • 3-[[1,3-ジオキソ-3-[3-[(1-オキソオクタデシル)アミノ]フェニル]プロピル]アミノ]-4-メトキシベンゼンスルホン酸
  • 4-メトキシ-3-[3-(3-オクタデカンアミドフェニル)-3-オキソプロパンアミド]ベンゼン-1-スルホン酸
  • 4-methoxy-3-[3-(3-octadecanamidophenyl)-3-oxopropanamido]benzene-1-sulfonic acid
Other name (1)：
  • 3-[[1,3-Dioxo-3-[3-[(1-oxooctadecyl)amino]phenyl]propyl]amino]-4-methoxybenzenesulfonic acid
CAS registry number： 27982-29-2
Regulation number (1)：
  • EINECS2487562
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