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CHEBI:43833 - N-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valine

ChEBI IDCHEBI:43833
ChEBI NameN-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valine
Stars
ASCII NameN-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valine
Last Modified11 February 2008
DownloadsMolfile
FormulaC20H23N5O4
Net Charge0
Average Mass397.435
Monoisotopic Mass397.17500
SMILES[H]OC(=O)[C@@]([H])(N([H])C(=O)c1c([H])c([H])c(C([H])([H])C([H])([H])c2c([H])n([H])c3nc(N([H])[H])n([H])c(=O)c23)c([H])c1[H])C([H])(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C20H23N5O4/c1-10(2)15(19(28)29)23-17(26)12-6-3-11(4-7-12)5-8-13-9-22-16-14(13)18(27)25-20(21)24-16/h3-4,6-7,9-10,15H,5,8H2,1-2H3,(H,23,26)(H,28,29)(H4,21,22,24,25,27)/t15-/m0/s1
InChIKeyMYENGRJSPURSQB-HNNXBMFYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valine (CHEBI:43833) is a pyrrolopyrimidine (CHEBI:38670)
N-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valine (CHEBI:43833) is a valine derivative (CHEBI:27267)
Synonyms  Source
2-{4-[2-(2-AMINO-4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)-ETHYL]-BENZOYLAMINO}-3-METHYL-BUTYRIC ACIDPDBeChem
N-({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)-L-valinePDBeChem
Manual XrefsDatabases
LYDPDBeChem