Chem
J-GLOBAL ID：201507019575465669   Nikkaji number：J3.426.392B

Mizagliflozin

ミザグリフロジン
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： C28H44N4O8
Molecular formula furigana： C28-H44-N4-O8
Molecular weight： 564.680
InChI： InChI=1S/C28H44N4O8/c1-15(2)21-19(25(32-31-21)40-26-24(36)23(35)22(34)20(13-33)39-26)12-17-7-8-18(11-16(17)3)38-10-6-9-30-14-28(4,5)27(29)37/h7-8,11,15,20,22-24,26,30,33-36H,6,9-10,12-14H2,1-5H3,(H2,29,37)(H,31,32)/t20-,22-,23+,24-,26+/m1/s1
InChI key： LREHMKLEOJAVMQ-TXKDOCKMSA-N
SMILES： CC(C)c1[nH]nc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(OCCCNCC(C)(C)C(=O)N)cc1C
Systematic name  (3)：
  • 3-[[3-[4-[[3-(β-D-グルコピラノシルオキシ)-5-イソプロピル-1H-ピラゾール-4-イル]メチル]-3-メチルフェノキシ]プロピル]アミノ]-2,2-ジメチルプロパンアミド
  • 2,2-ジメチル-3-{[3-(3-メチル-4-{[5-(プロパン-2-イル)-3-{[(2S,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]オキシ}-1H-ピラゾール-4-イル]メチル}フェノキシ)プロピル]アミノ}プロパンアミド
  • 2,2-dimethyl-3-{[3-(3-methyl-4-{[5-(propan-2-yl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H-pyrazol-4-yl]methyl}phenoxy)propyl]amino}propanamide
Other name (3)：
  • 3-[[3-[4-[[3-(β-D-Glucopyranosyloxy)-5-isopropyl-1H-pyrazole-4-yl]methyl]-3-methylphenoxy]propyl]amino]-2,2-dimethylpropanamide
  • Mizagliflozin
  • ミザグリフロジン
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