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

Details

Stereochemistry RACEMIC
Molecular Formula C28H26N2O8
Molecular Weight 518.5146
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-HYDROXYO-DEMETHYL MURAGLITAZAR

SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)C(O)COC3=CC=C(CN(CC(O)=O)C(=O)OC4=CC=C(O)C=C4)C=C3

InChI

InChIKey=GOYNBPQTZHYOBY-UHFFFAOYSA-N
InChI=1S/C28H26N2O8/c1-18-26(29-27(37-18)20-5-3-2-4-6-20)24(32)17-36-22-11-7-19(8-12-22)15-30(16-25(33)34)28(35)38-23-13-9-21(31)10-14-23/h2-14,24,31-32H,15-17H2,1H3,(H,33,34)

HIDE SMILES / InChI

Molecular Formula C28H26N2O8
Molecular Weight 518.5146
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:54:19 GMT 2023
Edited
by admin
on Sat Dec 16 16:54:19 GMT 2023
Record UNII
E6UR5L3YOK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-HYDROXYO-DEMETHYL MURAGLITAZAR
Common Name English
MURAGLITAZAR METABOLITE M7
Common Name English
GLYCINE, N-((4-(2-HYDROXY-2-(5-METHYL-2-PHENYL-4-OXAZOLYL)ETHOXY)PHENYL)METHYL)-N-((4-HYDROXYPHENOXY)CARBONYL)-
Systematic Name English
N-((4-(2-HYDROXY-2-(5-METHYL-2-PHENYL-4-OXAZOLYL)ETHOXY)PHENYL)METHYL)-N-((4-HYDROXYPHENOXY)CARBONYL)GLYCINE
Systematic Name English
Code System Code Type Description
FDA UNII
E6UR5L3YOK
Created by admin on Sat Dec 16 16:54:19 GMT 2023 , Edited by admin on Sat Dec 16 16:54:19 GMT 2023
PRIMARY
CAS
875430-20-9
Created by admin on Sat Dec 16 16:54:19 GMT 2023 , Edited by admin on Sat Dec 16 16:54:19 GMT 2023
PRIMARY
PUBCHEM
44448633
Created by admin on Sat Dec 16 16:54:19 GMT 2023 , Edited by admin on Sat Dec 16 16:54:19 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
FECAL