Chem
J-GLOBAL ID：200907017647535674   Nikkaji number：J1.313.704H

Sch-60663

Sch-60663
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： C30H31F2NO8
Molecular formula furigana： C30-H31-F2-N-O8
Molecular weight： 571.574
InChI： InChI=1S/C30H31F2NO8/c31-18-5-1-16(2-6-18)23(35)14-13-22-25(33(29(22)39)20-9-7-19(32)8-10-20)17-3-11-21(12-4-17)40-30-28(38)27(37)26(36)24(15-34)41-30/h1-12,22-28,30,34-38H,13-15H2/t22-,23+,24-,25-,26-,27+,28-,30-/m1/s1
InChI key： DVEBXQMHLKVMSN-IJJKIKCLSA-N
SMILES： OC[C@H]1O[C@@H](Oc2ccc(cc2)[C@@H]2[C@@H](CC[C@H](O)c3ccc(F)cc3)C(=O)N2c2ccc(F)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • (3R,4S)-3-[(S)-3-ヒドロキシ-3-(4-フルオロフェニル)プロピル]-1-(4-フルオロフェニル)-4-[4-(β-D-グルコピラノシルオキシ)フェニル]-2-アゼチジノン
  • (3R,4S)-1-(4-フルオロフェニル)-3-[(3S)-3-(4-フルオロフェニル)-3-ヒドロキシプロピル]-4-(4-{[(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}フェニル)アゼチジン-2-オン
  • (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)azetidin-2-one
Other name (2)：
  • (3R,4S)-3-[(S)-3-Hydroxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-[4-(β-D-glucopyranosyloxy)phenyl]-2-azetidinone
  • Sch-60663
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