CHEBI:174443 - 5-Hydroxydantrolene

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 5-Hydroxydantrolene
ChEBI ID CHEBI:174443
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H10N4O6
Net Charge 0
Average Mass 330.256
Monoisotopic Mass 330.06003
InChI InChI=1S/C14H10N4O6/c19-12-13(20)17(14(21)16-12)15-7-10-5-6-11(24-10)8-1-3-9(4-2-8)18(22)23/h1-7,13,20H,(H,16,19,21)/b15-7+
InChIKey PGORTQZSSAZLCK-VIZOYTHASA-N
SMILES O1C(C2=CC=C([N+]([O-])=O)C=C2)=CC=C1\C=N\N3C(O)C(=O)NC3=O
ChEBI Ontology
Outgoing 5-Hydroxydantrolene (CHEBI:174443) is a imidazolidine-2,4-dione (CHEBI:24628)
IUPAC Name
5-hydroxy-1-[(E)-[5-(4-nitrophenyl)uran-2-yl]methylideneamino]imidazolidine-2,4-dione
Manual Xrefs Databases
7851768 ChemSpider
HMDB0060776 HMDB
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Registry Number Type Source
52130-25-3 CAS Registry Number ChemIDplus