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CHEBI:43630 - 4-[(7R,7AS)-7-HYDROXY-1,3-DIOXOTETRAHYDRO-1H-PYRROLO[1,2-C]IMIDAZOL-2(3H)-YL]-1-NAPHTHONITRILE

Default Structure
ChEBI IDCHEBI:43630
ChEBI Name4-[(7R,7AS)-7-HYDROXY-1,3-DIOXOTETRAHYDRO-1H-PYRROLO[1,2-C]IMIDAZOL-2(3H)-YL]-1-NAPHTHONITRILE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC17H13N3O3
Net Charge0
Average Mass307.309
Monoisotopic Mass307.09569
SMILES[H]O[C@]1([H])C([H])([H])C([H])([H])N2C(=O)N(c3c([H])c([H])c(C#N)c4c([H])c([H])c([H])c([H])c34)C(=O)[C@@]21[H]
InChIInChI=1S/C17H13N3O3/c18-9-10-5-6-13(12-4-2-1-3-11(10)12)20-16(22)15-14(21)7-8-19(15)17(20)23/h1-6,14-15,21H,7-8H2/t14-,15+/m1/s1
InChIKeyNHBIWLQQJPSMNP-CABCVRRESA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(7R,7AS)-7-HYDROXY-1,3-DIOXOTETRAHYDRO-1H-PYRROLO[1,2-C]IMIDAZOL-2(3H)-YL]-1-NAPHTHONITRILE (CHEBI:43630) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-[(7R,7AS)-7-HYDROXY-1,3-DIOXOTETRAHYDRO-1H-PYRROLO[1,2-C]IMIDAZOL-2(3H)-YL]-1-NAPHTHONITRILEPDBeChem
4-[(7R,7aS)-7-hydroxy-1,3-dioxotetrahydro-1H-pyrrolo[1,2-c]imidazol-2(3H)-yl]naphthalene-1-carbonitrilePDBeChem
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