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Chemical structure of Euonymine

GC76315

Euonymine

Also known as [(1S,3R,13S,14S,17S,18R,19R,20R,21S,22R,23R,24R)-18,19,21,22,24-pentaacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

Euonymine (Euonymin) is a sesquiterpene pyridine alkaloid isolated from the leaves of Maytenus chiapensis

ChemicalCAS33458-82-1MW805.78FormulaC38H47NO18
CAS number
33458-82-1
Molecular weight
805.78
Formula
C38H47NO18
Solubility
Methanol： 0·76 mg/mL (0·94 mM; Need ultrasonic and warming)
InChIKey
PBFGAFDJVQAMRS-KCYQGYFWSA-N
Catalogue number
GC76315
Brand
GLPBIO
Computed properties PubChem CID 477607 · XLogP 0.5 · TPSA 253 Ų · H-bond donors 1
XLogP
0.5
TPSA
253 Ų
H-bond donors
1
H-bond acceptors
19
Rotatable bonds
13
Heavy atoms
57

SMILES C[C@H]1[C@@H](C(=O)O[C@H]2[C@@H]([C@@H]([C@]3([C@@H]([C@@H]([C@@H]4[C@H]([C@@]3(C2(C)O)O[C@]4(COC(=O)C5=C1N=CC=C5)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)C

Computed descriptors from PubChem (CID 477607), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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