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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H31NO5
Molecular Weight 401.4959
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RITOBEGRON ETHYL

SMILES

CCOC(=O)COC1=C(C)C=C(CCN[C@@H](C)[C@H](O)C2=CC=C(O)C=C2)C(C)=C1

InChI

InChIKey=SLXOKVKOBXCWCK-SBUREZEXSA-N
InChI=1S/C23H31NO5/c1-5-28-22(26)14-29-21-13-15(2)19(12-16(21)3)10-11-24-17(4)23(27)18-6-8-20(25)9-7-18/h6-9,12-13,17,23-25,27H,5,10-11,14H2,1-4H3/t17-,23-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
RITOBEGRON ETHYL
Common Name English
ACETIC ACID, 2-(4-(2-(((1S,2R)-2-HYDROXY-2-(4-HYDROXYPHENYL)-1-METHYLETHYL)AMINO)ETHYL)-2,5-DIMETHYLPHENOXY)-, ETHYL ESTER
Common Name English
RITOBEGRON ETHYL, (-)-
Common Name English
(-)-RITOBEGRON ETHYL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID30180263
Created by admin on Sat Dec 16 05:31:10 UTC 2023 , Edited by admin on Sat Dec 16 05:31:10 UTC 2023
PRIMARY
FDA UNII
E89L9L8KFH
Created by admin on Sat Dec 16 05:31:10 UTC 2023 , Edited by admin on Sat Dec 16 05:31:10 UTC 2023
PRIMARY
PUBCHEM
9810282
Created by admin on Sat Dec 16 05:31:10 UTC 2023 , Edited by admin on Sat Dec 16 05:31:10 UTC 2023
PRIMARY
CAS
255733-81-4
Created by admin on Sat Dec 16 05:31:10 UTC 2023 , Edited by admin on Sat Dec 16 05:31:10 UTC 2023
PRIMARY