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Chemical structure of Eupalinolide O

GC20068

Eupalinolide O

Also known as [(3aR,4R,6E,9S,10E,11aR)-9-acetyloxy-6-formyl-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-hydroxy-2-methylbut-2-enoate

Eupalinolide O is a sesquiterpene lactone with anticancer activities· Eupalinolide O induces cell apoptosis in human MDA-MB-468 breast cancer cells

ChemicalCAS2170228-67-6MW418.44FormulaC22H26O8
CAS number
2170228-67-6
Molecular weight
418.44
Formula
C22H26O8
InChIKey
MAIWERGSXNNKMK-KJXUJBMCSA-N
Catalogue number
GC20068
Brand
GLPBIO
Computed properties PubChem CID 154809464 · XLogP 1.1 · TPSA 116 Ų · H-bond donors 1
XLogP
1.1
TPSA
116 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
30

SMILES C/C/1=C\[C@@H]2[C@@H]([C@@H](C/C(=C\C[C@@H]1OC(=O)C)/C=O)OC(=O)/C(=C/CO)/C)C(=C)C(=O)O2

Computed descriptors from PubChem (CID 154809464), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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