Chem
J-GLOBAL ID：201107048021853853   Nikkaji number：J2.928.716C

Sergliflozin etabonate

セルグリフロジンエタボナート
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： C23H28O9
Molecular formula furigana： C23-H28-O9
Molecular weight： 448.468
InChI： InChI=1S/C23H28O9/c1-3-29-23(27)30-13-18-19(24)20(25)21(26)22(32-18)31-17-7-5-4-6-15(17)12-14-8-10-16(28-2)11-9-14/h4-11,18-22,24-26H,3,12-13H2,1-2H3/t18-,19-,20+,21-,22-/m1/s1
InChI key： QLXKHBNJTPICNF-QMCAAQAGSA-N
SMILES： CCOC(=O)OC[C@H]1O[C@@H](Oc2ccccc2Cc2ccc(OC)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (4)：
  • 炭酸エチル1-O-[2-(4-メトキシベンジル)フェニル]-6-デオキシ-β-D-グルコピラノース-6-イル
  • 2-(4-メトキシベンジル)フェニル6-O-(エトキシカルボニル)-β-D-グルコピラノシド
  • エチル [(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-{2-[(4-メトキシフェニル)メチル]フェノキシ}オキサン-2-イル]メチル カルボナート
  • ethyl [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{2-[(4-methoxyphenyl)methyl]phenoxy}oxan-2-yl]methyl carbonate
Other name (4)：
  • Carbonic acid ethyl 1-O-[2-(4-methoxybenzyl)phenyl]-6-deoxy-β-D-glucopyranose-6-yl ester
  • 2-(4-Methoxybenzyl)phenyl 6-O-(ethoxycarbonyl)-β-D-glucopyranoside
  • セルグリフロジンエタボナート
  • Sergliflozin etabonate
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