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Chemical structure of Isopteropodine

GC39076

Isopteropodine

Also known as methyl (1R,4aR,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate

Isopteropodine is heteroyohimbine-type oxindole alkaloid components of Uncaria tomentosa (Willd

ChemicalCAS5171-37-9MW368.43FormulaC21H24N2O4
CAS number
5171-37-9
Molecular weight
368.43
Formula
C21H24N2O4
Solubility
Soluble in DMSO
InChIKey
JMIAZDVHNCCPDM-VOBQHSATSA-N
Catalogue number
GC39076
Brand
GLPBIO
Computed properties PubChem CID 122813 · XLogP 1.6 · TPSA 67.9 Ų · H-bond donors 1
XLogP
1.6
TPSA
67.9 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
27

SMILES C[C@@H]1[C@H]2CN3CCC4(C3C[C@H]2C(=CO1)C(=O)OC)C5=CC=CC=C5NC4=O

Computed descriptors from PubChem (CID 122813), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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