CHEBI:82199 - Buturon

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Buturon
ChEBI ID CHEBI:82199
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C12H13ClN2O
Net Charge 0
Average Mass 236.69700
Monoisotopic Mass 236.07164
InChI InChI=1S/C12H13ClN2O/c1-4-9(2)15(3)12(16)14-11-7-5-10(13)6-8-11/h1,5-9H,2-3H3,(H,14,16)
InChIKey BYYMILHAKOURNM-UHFFFAOYSA-N
SMILES CC(C#C)N(C)C(=O)Nc1ccc(Cl)cc1
ChEBI Ontology
Outgoing Buturon (CHEBI:82199) is a ureas (CHEBI:47857)
Manual Xrefs Databases
1278 PPDB
C19074 KEGG COMPOUND
View more database links
Registry Number Type Source
3766-60-7 CAS Registry Number KEGG COMPOUND