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CHEBI:42020 - 3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONE

Default Structure
ChEBI IDCHEBI:42020
ChEBI Name3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONE
Stars
Secondary ChEBI IDCHEBI:47063
Last Modified26 July 2011
DownloadsMolfile
FormulaC20H18N4O
Net Charge0
Average Mass330.391
Monoisotopic Mass330.14806
SMILES[H]OC([H])([H])C([H])([H])N([H])c1nc([H])nc2c1c(-c1c([H])c([H])c([H])c([H])c1[H])c(-c1c([H])c([H])c([H])c([H])c1[H])n2[H]
InChIInChI=1S/C20H18N4O/c25-12-11-21-19-17-16(14-7-3-1-4-8-14)18(15-9-5-2-6-10-15)24-20(17)23-13-22-19/h1-10,13,25H,11-12H2,(H2,21,22,23,24)
InChIKeyMPJYGQHMIFDQIN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONE (CHEBI:42020) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-[(5,6-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethanolPDBeChem
3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONEPDBeChem
3-AMINO-3-BENZYL-[4.3.0]BICYCLO-1,6-DIAZANONAN-2-ONEPDBeChem
methyl [(1S)-1-({2-[(2S)-2-benzyl-2-hydroxy-3-{[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino}-3-oxopropyl]-2-(4-bromobenzyl)hydrazino}carbonyl)-2,2-dimethylpropyl]carbamate (non-preferred name)PDBeChem
Manual XrefsDatabases
1AHPDBeChem
DFZPDBeChem