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Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O4
Molecular Weight 182.1733
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL VANILLATE

SMILES

COC(=O)C1=CC(OC)=C(O)C=C1

InChI

InChIKey=BVWTXUYLKBHMOX-UHFFFAOYSA-N
InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Neuroprotective and free radical scavenging activities of phenolic compounds from Hovenia dulcis.
2005 Jul
Novel caffeic acid ester derivative induces apoptosis by expressing FasL and downregulating NF-KappaB: Potentiation of cell death mediated by chemotherapeutic agents.
2009 Mar
Combining substrate specificity analysis with support vector classifiers reveals feruloyl esterase as a phylogenetically informative protein group.
2010 Sep 22
Patents
Name Type Language
METHYL VANILLATE
Systematic Name English
4-HYDROXY-3-METHOXYBENZOIC ACID METHYL ESTER
Systematic Name English
VANILLIC ACID, METHYL ESTER
Systematic Name English
NSC-74385
Code English
4-HYDROXY-3-METHOXY METHYL BENZOATE
Systematic Name English
METHYL 3-METHOXY-4-HYDROXYBENZOATE
Systematic Name English
BENZOIC ACID, 4-HYDROXY-3-METHOXY-, METHYL ESTER
Systematic Name English
METHYL 4-HYDROXY-3-METHOXYBENZOATE
Systematic Name English
Code System Code Type Description
CHEBI
46477
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-525-9
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
CAS
3943-74-6
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
NSC
74385
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
DRUG BANK
DB08711
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
PUBCHEM
19844
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID5074345
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY
FDA UNII
2HXG8QSO3D
Created by admin on Fri Dec 15 17:49:05 GMT 2023 , Edited by admin on Fri Dec 15 17:49:05 GMT 2023
PRIMARY