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Chemical structure of Cardol triene

GC41400

Cardol triene

Also known as 5-[(8E,11E)-pentadeca-8,11,14-trienyl]benzene-1,3-diol

Cardol triene is a phenol found in cashew nut shell liquid that competitively and irreversibly inhibits mushroom tyrosinase (IC50 = 22·5 μM)

ChemicalCAS79473-24-8MW314.5FormulaC21H30O2
CAS number
79473-24-8
Molecular weight
314.5
Formula
C21H30O2
Solubility
DMF: 20 mg/ml,DMSO: 15 mg/ml,Ethanol: 22 mg/ml,Ethanol:PBS(pH 7·2) (1:1): 0·5 mg/ml
InChIKey
OOXBEOHCOCMKAC-AOSYACOCSA-N
Catalogue number
GC41400
Brand
GLPBIO
Computed properties PubChem CID 6440219 · XLogP 7.2 · TPSA 40.5 Ų · H-bond donors 2
XLogP
7.2
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
12
Heavy atoms
23

SMILES C=CC/C=C/C/C=C/CCCCCCCC1=CC(=CC(=C1)O)O

Computed descriptors from PubChem (CID 6440219), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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