Empagliflozin 3D structure

Empagliflozin (also called Empagliflozina, Empagliflozine) has the formula C23H27ClO7 and a molar mass of 450.9 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C23H27ClO7
Molar mass
450.9 g/mol
PubChem CID
11949646
Heavy atoms
31
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name(2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
SMILESC1COC[C@H]1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)Cl
PubChem CID11949646
Other namesEmpagliflozina, Empagliflozine, Empagliflozinum, C23H27ClO7

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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