Mitragynine 3D structure

Mitragynine (also called 9-Methoxycorynantheidine, Mitragynin) has the formula C23H30N2O4 and a molar mass of 398.5 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
C23H30N2O4
Molar mass
398.5 g/mol
PubChem CID
3034396
Heavy atoms
29
Category
Natural products

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC namemethyl (E)-2-[(2S,3S,12bS)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
SMILESCC[C@@H]1CN2CCC3=C([C@@H]2C[C@@H]1/C(=C\OC)/C(=O)OC)NC4=C3C(=CC=C4)OC
PubChem CID3034396
Other names9-Methoxycorynantheidine, Mitragynin, Mitragynine - 95%, Mitragynine - 97%, Mitragynine 100 microg/mL in Methanol

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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