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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H13NO2
Molecular Weight 203.2371
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of INDOXYL BUTYRATE

SMILES

CCCC(=O)OC1=CNC2=C1C=CC=C2

InChI

InChIKey=DPUSLOQBAPOARC-UHFFFAOYSA-N
InChI=1S/C12H13NO2/c1-2-5-12(14)15-11-8-13-10-7-4-3-6-9(10)11/h3-4,6-8,13H,2,5H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
INDOXYL BUTYRATE
Common Name English
INDOL-3-YL BUTYRATE
Systematic Name English
1H-INDOL-3-YL BUTYRATE
Common Name English
BUTANOIC ACID, 1H-INDOL-3-YL ESTER
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
224-404-3
Created by admin on Sat Dec 16 12:17:43 GMT 2023 , Edited by admin on Sat Dec 16 12:17:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID70195856
Created by admin on Sat Dec 16 12:17:43 GMT 2023 , Edited by admin on Sat Dec 16 12:17:43 GMT 2023
PRIMARY
FDA UNII
ADF524U6R4
Created by admin on Sat Dec 16 12:17:43 GMT 2023 , Edited by admin on Sat Dec 16 12:17:43 GMT 2023
PRIMARY
CAS
4346-15-0
Created by admin on Sat Dec 16 12:17:43 GMT 2023 , Edited by admin on Sat Dec 16 12:17:43 GMT 2023
PRIMARY
PUBCHEM
78047
Created by admin on Sat Dec 16 12:17:43 GMT 2023 , Edited by admin on Sat Dec 16 12:17:43 GMT 2023
PRIMARY