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CHEBI:49594 - 1-[1-(4-{[(2,4-DIAMINOPTERIDIN-6-YL)METHYL]AMINO}BENZYL)PIPERIDIN-4-YL]PROPAN-1-ONE

Default Structure
ChEBI IDCHEBI:49594
ChEBI Name1-[1-(4-{[(2,4-DIAMINOPTERIDIN-6-YL)METHYL]AMINO}BENZYL)PIPERIDIN-4-YL]PROPAN-1-ONE
Stars
DownloadsMolfile
FormulaC22H28N8O
Net Charge0
Average Mass420.521
Monoisotopic Mass420.23861
SMILES[H]c1nc2nc(N([H])[H])nc(N([H])[H])c2nc1C([H])([H])N([H])c1c([H])c([H])c(C([H])([H])N2C([H])([H])C([H])([H])C([H])(C(=O)C([H])([H])C([H])([H])[H])C([H])([H])C2([H])[H])c([H])c1[H]
InChIInChI=1S/C22H28N8O/c1-2-18(31)15-7-9-30(10-8-15)13-14-3-5-16(6-4-14)25-11-17-12-26-21-19(27-17)20(23)28-22(24)29-21/h3-6,12,15,25H,2,7-11,13H2,1H3,(H4,23,24,26,28,29)
InChIKeyDOEVVOHGRLMSRO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[1-(4-{[(2,4-DIAMINOPTERIDIN-6-YL)METHYL]AMINO}BENZYL)PIPERIDIN-4-YL]PROPAN-1-ONE (CHEBI:49594) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-[1-(4-{[(2,4-diaminopteridin-6-yl)methyl]amino}benzyl)piperidin-4-yl]propan-1-onePDBeChem
1-[1-(4-{[(2,4-DIAMINOPTERIDIN-6-YL)METHYL]AMINO}BENZYL)PIPERIDIN-4-YL]PROPAN-1-ONEPDBeChem
Manual XrefsDatabases
DYPPDBeChem