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CHEBI:40217 - 2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE

Default Structure
ChEBI IDCHEBI:40217
ChEBI Name2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC19H20N4O2
Net Charge0
Average Mass336.395
Monoisotopic Mass336.15863
SMILES[H]c1c([H])c(OC2([H])C([H])([H])C([H])([H])C([H])([H])C2([H])[H])c([O-])c(-c2nc3c([H])c(C(N([H])[H])=[N+]([H])[H])c([H])c([H])c3n2[H])c1[H]
InChIInChI=1S/C19H20N4O2/c20-18(21)11-8-9-14-15(10-11)23-19(22-14)13-6-3-7-16(17(13)24)25-12-4-1-2-5-12/h3,6-10,12,24H,1-2,4-5H2,(H3,20,21)(H,22,23)
InChIKeyWCFWDBPDMBXMTQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE (CHEBI:40217) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATEPDBeChem
2-{5-[amino(iminio)methyl]-1H-benzimidazol-2-yl}-6-(cyclopentyloxy)phenolatePDBeChem
Manual XrefsDatabases
655PDBeChem