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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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
MVY96B1KA0
Record Status Validated (UNII)
Record Version