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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24Br2N10O2
Molecular Weight 620.3
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AGELIFERIN

SMILES

NC1=NC=C(N1)[C@@H]2[C@H](CNC(=O)C3=CC(Br)=CN3)[C@@H](CNC(=O)C4=CC(Br)=CN4)CC5=C2N=C(N)N5

InChI

InChIKey=DMMLTRAQSJWUHT-KSYCPYKJSA-N
InChI=1S/C22H24Br2N10O2/c23-10-2-14(27-5-10)19(35)29-4-9-1-13-18(34-22(26)32-13)17(16-8-31-21(25)33-16)12(9)7-30-20(36)15-3-11(24)6-28-15/h2-3,5-6,8-9,12,17,27-28H,1,4,7H2,(H,29,35)(H,30,36)(H3,25,31,33)(H3,26,32,34)/t9-,12-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H24Br2N10O2
Molecular Weight 620.3
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
P4YF5N7VXX
Record Status Validated (UNII)
Record Version