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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H23NO5
Molecular Weight 381.4217
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AVE-8134

SMILES

CC1=CC=CC(COCCCOCC2=COC(=N2)C3=CC=CC=C3)=C1C(O)=O

InChI

InChIKey=WLHOBCUVPMOXAT-UHFFFAOYSA-N
InChI=1S/C22H23NO5/c1-16-7-5-10-18(20(16)22(24)25)13-26-11-6-12-27-14-19-15-28-21(23-19)17-8-3-2-4-9-17/h2-5,7-10,15H,6,11-14H2,1H3,(H,24,25)

HIDE SMILES / InChI

Molecular Formula C22H23NO5
Molecular Weight 381.4217
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:13:10 UTC 2023
Edited
by admin
on Sat Dec 16 15:13:10 UTC 2023
Record UNII
O9SA2C9EII
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AVE-8134
Code English
2-METHYL-6-((3-((2-PHENYL-4-OXAZOLYL)METHOXY)PROPOXY)METHYL)BENZOIC ACID
Systematic Name English
BENZOIC ACID, 2-METHYL-6-((3-((2-PHENYL-4-OXAZOLYL)METHOXY)PROPOXY)METHYL)-
Systematic Name English
Code System Code Type Description
CAS
304025-09-0
Created by admin on Sat Dec 16 15:13:10 UTC 2023 , Edited by admin on Sat Dec 16 15:13:10 UTC 2023
PRIMARY
PUBCHEM
11625114
Created by admin on Sat Dec 16 15:13:10 UTC 2023 , Edited by admin on Sat Dec 16 15:13:10 UTC 2023
PRIMARY
FDA UNII
O9SA2C9EII
Created by admin on Sat Dec 16 15:13:10 UTC 2023 , Edited by admin on Sat Dec 16 15:13:10 UTC 2023
PRIMARY
SMS_ID
300000042360
Created by admin on Sat Dec 16 15:13:10 UTC 2023 , Edited by admin on Sat Dec 16 15:13:10 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
EC50
Related Record Type Details
ACTIVE MOIETY