CHEBI:229242 - AS-1269574

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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 AS-1269574
ChEBI ID CHEBI:229242
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H14BrN3O
Net Charge 0
Average Mass 308.179
Monoisotopic Mass 307.03202
InChI InChI=1S/C13H14BrN3O/c1-9-8-12(15-6-7-18)17-13(16-9)10-2-4-11(14)5-3-10/h2-5,8,18H,6-7H2,1H3,(H,15,16,17)
InChIKey DUKPGOOUJNUIOI-UHFFFAOYSA-N
SMILES BrC1=CC=C(C=2N=C(NCCO)C=C(N2)C)C=C1
Metabolite of Species Details
Oryctolagus cuniculus (NCBI:txid9986) Found in longissimus thoracis (BTO:0001651). See: MetaboLights Study
ChEBI Ontology
Outgoing AS-1269574 (CHEBI:229242) is a organobromine compound (CHEBI:37141)
IUPAC Name
2-[[2-(4-bromophenyl)-6-methylpyrimidin-4-yl]amino]ethanol
Manual Xref Database
4490008 ChemSpider
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