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Chemical structure of Methylcardol triene

GC41616

Methylcardol triene

Also known as 2-methyl-4-[(4Z,7Z,10E)-pentadeca-4,7,10-trien-2-yl]benzene-1,3-diol

Methylcardol triene is a phenol found in cashew nut shell liquid that inhibits α-glucosidase (IC50 = 39·6 μM)

ChemicalCAS50423-15-9MW328.5FormulaC22H32O2
CAS number
50423-15-9
Molecular weight
328.5
Formula
C22H32O2
Solubility
Soluble in DMSO
InChIKey
LFBUKLGLQVJWJQ-AERNHLEVSA-N
Catalogue number
GC41616
Brand
GLPBIO
Computed properties PubChem CID 6442391 · XLogP 6.9 · TPSA 40.5 Ų · H-bond donors 2
XLogP
6.9
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
10
Heavy atoms
24

SMILES CCCC/C=C/C/C=C\C/C=C\CC(C)C1=C(C(=C(C=C1)O)C)O

Computed descriptors from PubChem (CID 6442391), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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