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Calebin A
PubChem ID
637429
Chemical Name
Calebin A
Molecular Formula
C
21
H
20
O
7
Canonical SMILES
COC1=C(C=CC(=C1)C=CC(=O)COC(=O)C=CC2=CC(=C(C=C2)O)OC)O
IUPAC Name
[(E)-4-(4-hydroxy-3-methoxyphenyl)-2-oxobut-3-enyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Molecular Weight
384.384 g/mol
XLogP
3.3
Rotatable Bond Count
9
Lipinsky's Rule of Five
Yes
Sources
Turmeric
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2D SDF
3D SDF
mol
JPEG
Biological Activities
1. Apoptosis inducer
2. Antiproliferative