4-METHYLUMBELLIFERYL ACETATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H10O4
Molecular Weight	218.2054
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-METHYLUMBELLIFERYL ACETATE

Structure Search

SMILES

CC(=O)OC1=CC2=C(C=C1)C(C)=CC(=O)O2

InChI

InChIKey=HXVZGASCDAGAPS-UHFFFAOYSA-N

InChI=1S/C12H10O4/c1-7-5-12(14)16-11-6-9(15-8(2)13)3-4-10(7)11/h3-6H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H10O4
Molecular Weight	218.2054
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Acyl coenzyme A:cholesterol acyltransferase 15 Target ID: CHEMBL2265 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29407485	Substrate 661
Carboxylesterase 2 9 Target ID: CHEMBL3180 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29407485	Substrate 661
O-acetylpeptidoglycan esterase 1 (Neisseria gonorrhoeae, F7VJJ8) 1 Target ID: O-acetylpeptidoglycan esterase 1 (Neisseria gonorrhoeae, F7VJJ8) Sources: https://www.ncbi.nlm.nih.gov/pubmed/22351512	Substrate 661

PubMed

Title	Date	PubMed
Characterization of the glutathione S-transferases that belong to the GSTFuA class in Ceriporiopsis subvermispora: Implications in intracellular detoxification and metabolism of wood-derived compounds.	2018-07-01	29524495
Presence and inter-individual variability of carboxylesterases (CES1 and CES2) in human lung.	2018-04	29407485
Colorimetric Detection of Acetyl Xylan Esterase Activities.	2017	28417360
Replacement of carbohydrate binding modules improves acetyl xylan esterase activity and its synergistic hydrolysis of different substrates with xylanase.	2016-10-22	27770795
Enhancement of acetyl xylan esterase activity on cellulose acetate through fusion to a family 3 cellulose binding module.	2015-11	26320711
A fluorescence-based hydrolytic enzyme activity assay for quantifying toxic effects of Roundup® to Daphnia magna.	2015-08	25809520
Esterase Activity and Intracellular Localization in Reconstructed Human Epidermal Cultured Skin Models.	2015-06	26082583
Structural characterization and function determination of a nonspecific carboxylate esterase from the amidohydrolase superfamily with a promiscuous ability to hydrolyze methylphosphonate esters.	2014-06-03	24832101
Bacteriophage 933W encodes a functional esterase downstream of the Shiga toxin 2a operon.	2014-05	24290913
Adsorption of microbial esterases on Bacillus subtilis-templated cobalt oxide nanoparticles.	2014-04	24444878
Automated carboxylesterase assay for the evaluation of ionic liquids' human toxicity.	2013-01-15	23245880
Identification of the first known inhibitors of O-acetylpeptidoglycan esterase: a potential new antibacterial target.	2012-03-19	22351512

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:18:57 GMT 2025` Edited by `admin` on `Mon Mar 31 22:18:57 GMT 2025`
Record UNII	ZD294D576M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-1059

Preferred Name

English

4-METHYLUMBELLIFERYL ACETATE

Common Name

English

7-ACETOXY-4-METHYLCOUMARIN

Systematic Name

English

COUMARIN, 7-HYDROXY-4-METHYL-, ACETATE

Systematic Name

English

NSC-31658

Code

English

7-HYDROXY-4-METHYLCOUMARIN ACETATE

Systematic Name

English

.BETA.-METHYLUMBELLIFERONE ACETATE

Common Name

English

2H-1-BENZOPYRAN-2-ONE, 7-(ACETYLOXY)-4-METHYL-

Systematic Name

English

NSC-44763

Code

English

7-(ACETYLOXY)-4-METHYLCOUMARIN

Systematic Name

English

Code System Code Type Description

CAS

2747-05-9