Yohimbine 3D structure

Yohimbine (also called Yohimbin, Quebrachine) has the formula C21H26N2O3 and a molar mass of 354.4 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
C21H26N2O3
Molar mass
354.4 g/mol
PubChem CID
8969
Heavy atoms
26
Category
Natural products

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC namemethyl (1S,15R,18S,19R,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
SMILESCOC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)O
PubChem CID8969
Other namesYohimbin, Quebrachine, Corynine, Quebrachin, Yohimbic acid methyl ester

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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