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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H20ClN3O4
Molecular Weight 449.886
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-8722

SMILES

[H][C@]12OC[C@@H](OC3=NC4=NC(C5=CC=C(C=C5)C6=CC=CC=C6)=C(Cl)C=C4N3)[C@@]1([H])OC[C@H]2O

InChI

InChIKey=XQMNBTZLYOOAGA-UGESXGAOSA-N
InChI=1S/C24H20ClN3O4/c25-16-10-17-23(28-24(26-17)32-19-12-31-21-18(29)11-30-22(19)21)27-20(16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-10,18-19,21-22,29H,11-12H2,(H,26,27,28)/t18-,19-,21-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H20ClN3O4
Molecular Weight 449.886
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:21:10 GMT 2023
Edited
by admin
on Sat Dec 16 19:21:10 GMT 2023
Record UNII
RW3ZG69SHT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MK-8722
Common Name English
D-Mannitol, 1,4:3,6-dianhydro-2-O-(5-[1,1′-biphenyl]-4-yl-6-chloro-3H-imidazo[4,5-b]pyridin-2-yl)-
Systematic Name English
1,4:3,6-Dianhydro-2-O-(5-[1,1′-biphenyl]-4-yl-6-chloro-3H-imidazo[4,5-b]pyridin-2-yl)-D-mannitol
Common Name English
Code System Code Type Description
FDA UNII
RW3ZG69SHT
Created by admin on Sat Dec 16 19:21:10 GMT 2023 , Edited by admin on Sat Dec 16 19:21:10 GMT 2023
PRIMARY
SMS_ID
300000042486
Created by admin on Sat Dec 16 19:21:10 GMT 2023 , Edited by admin on Sat Dec 16 19:21:10 GMT 2023
PRIMARY
CAS
1394371-71-1
Created by admin on Sat Dec 16 19:21:10 GMT 2023 , Edited by admin on Sat Dec 16 19:21:10 GMT 2023
PRIMARY
PUBCHEM
89558344
Created by admin on Sat Dec 16 19:21:10 GMT 2023 , Edited by admin on Sat Dec 16 19:21:10 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> ACTIVATOR
Ki
TARGET -> ACTIVATOR
Ki