Chemical Component Summary

Name(2R)-2-(7-amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid
Identifiers(2R)-2-[7-azanyl-4,5-bis(oxidanylidene)-1,6-dihydropyrimido[4,5-c]pyridazin-3-yl]propanoic acid
FormulaC9 H9 N5 O4
Molecular Weight251.199
TypeNON-POLYMER
Isomeric SMILESC[C@H](C1=NNC2=C(C1=O)C(=O)NC(=N2)N)C(=O)O
InChIInChI=1S/C9H9N5O4/c1-2(8(17)18)4-5(15)3-6(14-13-4)11-9(10)12-7(3)16/h2H,1H3,(H,17,18)(H4,10,11,12,14,15,16)/t2-/m1/s1
InChIKeyGMTZUGVMBRNPHI-UWTATZPHSA-N

Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count1
Bond Count28
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 56928048, 135566691