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

Details

Stereochemistry UNKNOWN
Molecular Formula C29H28N2O9
Molecular Weight 548.5406
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9,12-DIHYDROXY MURAGLITAZAR

SMILES

COC1=CC=C(OC(=O)N(CC(O)=O)CC2=CC=C(OCC(O)C3=C(CO)OC(=N3)C4=CC=CC=C4)C=C2)C=C1

InChI

InChIKey=OODRCEMTQNDYEZ-UHFFFAOYSA-N
InChI=1S/C29H28N2O9/c1-37-21-11-13-23(14-12-21)39-29(36)31(16-26(34)35)15-19-7-9-22(10-8-19)38-18-24(33)27-25(17-32)40-28(30-27)20-5-3-2-4-6-20/h2-14,24,32-33H,15-18H2,1H3,(H,34,35)

HIDE SMILES / InChI

Molecular Formula C29H28N2O9
Molecular Weight 548.5406
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 16:09:57 GMT 2023
Edited
by admin
on Sat Dec 16 16:09:57 GMT 2023
Record UNII
MVY96B1KA0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9,12-DIHYDROXY MURAGLITAZAR
Common Name English
GLYCINE, N-((4-(2-HYDROXY-2-(5-(HYDROXYMETHYL)-2-PHENYL-4-OXAZOLYL)ETHOXY)PHENYL)METHYL)-N-((4-METHOXYPHENOXY)CARBONYL)-
Systematic Name English
N-((4-(2-HYDROXY-2-(5-(HYDROXYMETHYL)-2-PHENYL-4-OXAZOLYL)ETHOXY)PHENYL)METHYL)-N-((4-METHOXYPHENOXY)CARBONYL)GLYCINE
Systematic Name English
MURAGLITAZAR METABOLITE M4
Common Name English
Code System Code Type Description
CAS
875430-17-4
Created by admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
PRIMARY
FDA UNII
MVY96B1KA0
Created by admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
PRIMARY
PUBCHEM
44448635
Created by admin on Sat Dec 16 16:09:57 GMT 2023 , Edited by admin on Sat Dec 16 16:09:57 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
FECAL