U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H12O6
Molecular Weight 288.2522
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASPALATONE

SMILES

CC(=O)OC1=CC=CC=C1C(=O)OC2=C(C)OC=CC2=O

InChI

InChIKey=JVBIZYPCGNCWIT-UHFFFAOYSA-N
InChI=1S/C15H12O6/c1-9-14(12(17)7-8-19-9)21-15(18)11-5-3-4-6-13(11)20-10(2)16/h3-8H,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H12O6
Molecular Weight 288.2522
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Effect of vehicles and enhancers on the in vitro skin penetration of aspalatone and its enzymatic degradation across rat skins.
2001 Dec
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:14:19 GMT 2023
Edited
by admin
on Fri Dec 15 18:14:19 GMT 2023
Record UNII
A233M007P0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASPALATONE
Common Name English
ACETYLSALICYLIC ACID MATOL ESTER
Common Name English
2-(ACETYLOXY)-2-METHYL-4-OXO-4H-PYRAN-3-YL-BENZOIC ACID ESTER
Systematic Name English
Code System Code Type Description
MESH
C091320
Created by admin on Fri Dec 15 18:14:19 GMT 2023 , Edited by admin on Fri Dec 15 18:14:19 GMT 2023
PRIMARY
FDA UNII
A233M007P0
Created by admin on Fri Dec 15 18:14:19 GMT 2023 , Edited by admin on Fri Dec 15 18:14:19 GMT 2023
PRIMARY
EPA CompTox
DTXSID90163638
Created by admin on Fri Dec 15 18:14:19 GMT 2023 , Edited by admin on Fri Dec 15 18:14:19 GMT 2023
PRIMARY
CAS
147249-33-0
Created by admin on Fri Dec 15 18:14:19 GMT 2023 , Edited by admin on Fri Dec 15 18:14:19 GMT 2023
PRIMARY
PUBCHEM
197341
Created by admin on Fri Dec 15 18:14:19 GMT 2023 , Edited by admin on Fri Dec 15 18:14:19 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY