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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O4
Molecular Weight 196.1999
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4,5-TRIMETHOXYLBENZALDEHYDE

SMILES

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

InChI

InChIKey=IAJBQAYHSQIQRE-UHFFFAOYSA-N
InChI=1S/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3

HIDE SMILES / InChI
2,4,5-trimethoxybenzaldehyde, also known as asaraldehyde or gazarin, belongs to benzoyl derivatives class of compounds. 2,4,5-trimethoxybenzaldehyde can be found in carrot, herbs and spices, root vegetables, and wild carrot, and is a constituent of a bitter principle of these products. 2,4,5-trimethoxybenzaldehyde is an inhibitor of cyclooxygenase 2.

Originator

Curator's Comment: Properties of asary aldehyde were studied in 1910 by Fabinyi and Szeki.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
2,4,5-trimethoxybenzaldehyde, a bitter principle in plants, suppresses adipogenesis through the regulation of ERK1.
2014 Oct 8
Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
2,4,5-Trimethoxybenzaldehyde showed 3.32% of prostaglandin H endoperoxide synthase-I (COX-I) inhibitory activity and 52.69% prostaglandin H endoperoxide synthase-II (COX-II) inhibitory activity at 100 mg/mL-1.
Name Type Language
2,4,5-TRIMETHOXYLBENZALDEHYDE
Systematic Name English
BENZALDEHYDE, 2,4,5-TRIMETHOXY-
Systematic Name English
ASARYLALDEHYDE
Common Name English
GAZARIN
Common Name English
TRIMETHOXYBENZALDEHYDE, 2,4,5-
Systematic Name English
3,4,6-TRIMETHOXYBENZALDEHYDE
Systematic Name English
2,4,5-TRIMETHOXYBENZALDEHYDE
HSDB  
Systematic Name English
NSC-89299
Code English
AZARYLALDEHYDE
Common Name English
2,4,5-TRIMETHOXYBENZALDEHYDE [HSDB]
Common Name English
ASARALDEHYDE
Common Name English
ASARONALDEHYDE
Common Name English
Code System Code Type Description
PUBCHEM
20525
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
ECHA (EC/EINECS)
224-713-3
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
FDA UNII
NDU8J2Q00D
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID1022217
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
NSC
89299
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
HSDB
4502
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY
CAS
4460-86-0
Created by admin on Sat Dec 16 04:30:38 GMT 2023 , Edited by admin on Sat Dec 16 04:30:38 GMT 2023
PRIMARY