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Chemical structure of Futoquinol

GC72016

Futoquinol

Also known as 4-[(E)-1-(1,3-benzodioxol-5-yl)prop-1-en-2-yl]-4,5-dimethoxy-2-prop-2-enylcyclohexa-2,5-dien-1-one

Futoquinol is a neolignan isolated from the dried aerial parts of Piper kadsura (Piperaceae)

ChemicalCAS28178-92-9MW354.4FormulaC21H22O5
CAS number
28178-92-9
Molecular weight
354.4
Formula
C21H22O5
InChIKey
AOZTYYBGNNXAOI-NTEUORMPSA-N
Catalogue number
GC72016
Brand
GLPBIO
Computed properties PubChem CID 5281817 · XLogP 3.9 · TPSA 54 Ų · H-bond donors 0
XLogP
3.9
TPSA
54 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26

SMILES C/C(=C\C1=CC2=C(C=C1)OCO2)/C3(C=C(C(=O)C=C3OC)CC=C)OC

Computed descriptors from PubChem (CID 5281817), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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