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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28N6O4
Molecular Weight 440.4955
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APC-366

SMILES

NC(=N)NCCC[C@H](NC(=O)C1=CC=C2C=CC=CC2=C1O)C(=O)N3CCC[C@H]3C(N)=O

InChI

InChIKey=SKYWIMYOGAWOMB-IRXDYDNUSA-N
InChI=1S/C22H28N6O4/c23-19(30)17-8-4-12-28(17)21(32)16(7-3-11-26-22(24)25)27-20(31)15-10-9-13-5-1-2-6-14(13)18(15)29/h1-2,5-6,9-10,16-17,29H,3-4,7-8,11-12H2,(H2,23,30)(H,27,31)(H4,24,25,26)/t16-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H28N6O4
Molecular Weight 440.4955
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
BOSAPTLE0I
Record Status Validated (UNII)
Record Version