Chem
J-GLOBAL ID：201507007824975208   Nikkaji number：J3.437.712J

1-(β-D-Glucopyranosyl)-3-[(1,1′-biphenyl-4-yl)carbonyl]urea

1-(β-D-グルコピラノシル)-3-[(1,1′-ビフェニル-4-イル)カルボニル]尿素
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： C20H22N2O7
Molecular formula furigana： C20-H22-N2-O7
Molecular weight： 402.403
InChI： InChI=1S/C20H22N2O7/c23-10-14-15(24)16(25)17(26)19(29-14)22-20(28)21-18(27)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,14-17,19,23-26H,10H2,(H2,21,22,27,28)/t14-,15-,16+,17-,19-/m1/s1
InChI key： ZINVIKWRSBKXJV-OGJJZOIMSA-N
SMILES： OC[C@H]1O[C@@H](NC(=O)NC(=O)c2ccc(cc2)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 1-(β-D-グルコピラノシル)-3-[(1,1′-ビフェニル-4-イル)カルボニル]尿素
  • 1-{[1,1'-ビフェニル]-4-カルボニル}-3-[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]尿素
  • 1-{[1,1'-biphenyl]-4-carbonyl}-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]urea
Other name (1)：
  • 1-(β-D-Glucopyranosyl)-3-[(1,1′-biphenyl-4-yl)carbonyl]urea
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