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Chemical structure of Glyasperin C

GC63993

Glyasperin C

Also known as 4-[(3R)-7-hydroxy-5-methoxy-6-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-3-yl]benzene-1,3-diol

Glyasperin C is a potent and reversible noncompetitive inhibitor of neuraminidase with an IC50 of 20% at 200 μM

ChemicalCAS142474-53-1MW356.41FormulaC21H24O5
CAS number
142474-53-1
Molecular weight
356.41
Formula
C21H24O5
InChIKey
RCZMWVKBVFOCEE-ZDUSSCGKSA-N
Catalogue number
GC63993
Brand
GLPBIO
Computed properties PubChem CID 480859 · XLogP 4.5 · TPSA 79.2 Ų · H-bond donors 3
XLogP
4.5
TPSA
79.2 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

SMILES CC(=CCC1=C(C2=C(C=C1O)OC[C@H](C2)C3=C(C=C(C=C3)O)O)OC)C

Computed descriptors from PubChem (CID 480859), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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