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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=C(O)C(OC)=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

Molecular Formula C9H10O4
Molecular Weight 182.1733
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Combining substrate specificity analysis with support vector classifiers reveals feruloyl esterase as a phylogenetically informative protein group.
2010-09-22
Phenolic compounds in cherry ( Prunus avium ) heartwood with a view to their use in cooperage.
2010-04-28
Volatile compounds of red wines macerated with Spanish, American, and French oak chips.
2009-07-22
Novel caffeic acid ester derivative induces apoptosis by expressing FasL and downregulating NF-KappaB: Potentiation of cell death mediated by chemotherapeutic agents.
2009-03
Methyl 4-but-oxy-3-methoxy-benzoate.
2009-01-31
Methyl 4-(3-chloro-prop-oxy)-3-methoxy-benzoate.
2009-01-08
Downregulation of inflammatory responses by novel caffeic acid ester derivative by inhibiting NF-kappa B.
2009-01
Oxidation of lignin using aqueous polyoxometalates in the presence of alcohols.
2008
Ethnopharmacological evaluation of radal (leaves of Lomatia hirsuta) and isolation of 2-methoxyjuglone.
2006-08-31
Linear sesquiterpene lactones from Anthemis auriculata and their antibacterial activity.
2006-04
Neuroprotective and free radical scavenging activities of phenolic compounds from Hovenia dulcis.
2005-07
Molecular determinants of substrate specificity in the feruloyl esterase module of xylanase 10B from Clostridium thermocellum.
2005-02
4-Hydroxy-3-methoxybenzoic acid methyl ester: a curcumin derivative targets Akt/NF kappa B cell survival signaling pathway: potential for prostate cancer management.
2003-07-19
Purification and characterization of PrbA, a new esterase from Enterobacter cloacae hydrolyzing the esters of 4-hydroxybenzoic acid (parabens).
2003-04-11
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:53:39 GMT 2025
Edited
by admin
on Mon Mar 31 18:53:39 GMT 2025
Record UNII
2HXG8QSO3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-74385
Preferred Name English
METHYL VANILLATE
Systematic Name English
4-HYDROXY-3-METHOXYBENZOIC ACID METHYL ESTER
Systematic Name English
VANILLIC ACID, METHYL ESTER
Systematic Name 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 Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
ECHA (EC/EINECS)
223-525-9
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
CAS
3943-74-6
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
NSC
74385
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
DRUG BANK
DB08711
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
PUBCHEM
19844
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID5074345
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY
FDA UNII
2HXG8QSO3D
Created by admin on Mon Mar 31 18:53:39 GMT 2025 , Edited by admin on Mon Mar 31 18:53:39 GMT 2025
PRIMARY