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Chemical structure of 16-carboxy Mitragynine

GC91501

16-carboxy Mitragynine

Also known as (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-enoic acid

16-carboxy Mitragynine is an analytical reference standard categorized as an opioid

ChemicalCAS1224429-90-6MW384.5FormulaC22H28N2O4
CAS number
1224429-90-6
Molecular weight
384.5
Formula
C22H28N2O4
Solubility
Methanol： Soluble
InChIKey
USALYFVQBMRXDH-XZNUVMSOSA-N
Catalogue number
GC91501
Brand
GLPBIO
Computed properties PubChem CID 155143670 · XLogP 0.8 · TPSA 74.8 Ų · H-bond donors 2
XLogP
0.8
TPSA
74.8 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
28

SMILES CC[C@@H]1CN2CCC3=C([C@@H]2C[C@@H]1/C(=C\OC)/C(=O)O)NC4=C3C(=CC=C4)OC

Computed descriptors from PubChem (CID 155143670), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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