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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H27N5O5
Molecular Weight 441.4803
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SIRPIGLENASTAT

SMILES

CC(C)OC(=O)[C@H](CCC(=O)C=[N+]=[N-])NC(=O)[C@H](CC1=CNC2=CC=CC=C12)NC(C)=O

InChI

InChIKey=LQNMCWOJACNQQM-PMACEKPBSA-N
InChI=1S/C22H27N5O5/c1-13(2)32-22(31)19(9-8-16(29)12-25-23)27-21(30)20(26-14(3)28)10-15-11-24-18-7-5-4-6-17(15)18/h4-7,11-13,19-20,24H,8-10H2,1-3H3,(H,26,28)(H,27,30)/t19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H27N5O5
Molecular Weight 441.4803
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
9GGE6A0ZMK
Record Status Validated (UNII)
Record Version