3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one (CHEBI:42603)

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ChEBI Name	3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one

ChEBI ID	CHEBI:42603

Definition	An oxazoline derivative having an oxo group at the 2-position and an N-{[(5-nitro-2-furyl)methylene]amino} substituent.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C8H5N3O5

Net Charge

Average Mass

223.14240

Monoisotopic Mass

223.02292

InChI

InChI=1S/C8H5N3O5/c12-8-10(3-4-15-8)9-5-6-1-2-7(16-6)11(13)14/h1-5H/b9-5+

InChIKey

OEJYWOUVKXLNIN-WEVVVXLNSA-N

SMILES

[O-][N+](=O)c1ccc(\C=N\n2ccoc2=O)o1

Roles Classification
Biological Role(s):	epitope The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.

ChEBI Ontology
Outgoing	3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one (CHEBI:42603) has role epitope (CHEBI:53000) 3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one (CHEBI:42603) is a C-nitro compound (CHEBI:35716) 3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one (CHEBI:42603) is a furans (CHEBI:24129) 3-{[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2-one (CHEBI:42603) is a oxazoline (CHEBI:38327)

IUPAC Name

3-{(E)-[(5-nitrofuran-2-yl)methylidene]amino}-1,3-oxazol-2(3H)-one

Synonym	Source
3-{[(5-nitro-2-furyl)methylene]amino}-1,3-oxazol-2(3H)-one	ChEBI

Registry Number	Type	Source
753373	Beilstein Registry Number	Beilstein

Last Modified

31 December 2016