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Chemical structure of 3,4,5-Trimethoxycinnamic acid

GC66255

3,4,5-Trimethoxycinnamic acid

Also listed as (E)-3,4,5-Trimethoxycinnamic acid

(E)-3,4,5-Trimethoxycinnamic acid (TMCA) is a cinnamic acid substituted by multi-methoxy groups· (E)-3,4,5-Trimethoxycinnamic acid is an orally active and potent GABAA/BZ receptor agonist· (E)-3,4,5-Trimethoxycinnamic exhibits favourable binding affinity to 5-HT2C and 5-HT1A receptor, with IC50 values of 2·5 and 7·6 μM, respectively· (E)-3,4,5-Trimethoxycinnamic acid shows anticonvulsant and sedative activity· (E)-3,4,5-Trimethoxycinnamic acid can be used for the research of insomnia, headache and epilepsy

ChemicalCAS20329-98-0MW238.24FormulaC12H14O5
CAS number
20329-98-0
Molecular weight
238.24
Formula
C12H14O5
Solubility
DMSO ： 100 mg/mL (419·74 mM; Need ultrasonic)
InChIKey
YTFVRYKNXDADBI-SNAWJCMRSA-N
Catalogue number
GC66255
Brand
GLPBIO
Computed properties PubChem CID 735755 · XLogP 1.4 · TPSA 65 Ų · H-bond donors 1
XLogP
1.4
TPSA
65 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
17

SMILES COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)O

Computed descriptors from PubChem (CID 735755), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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