CHEBI:228606 - FMK

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 FMK
ChEBI ID CHEBI:228606
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H19FN4O2
Net Charge 0
Average Mass 342.374
Monoisotopic Mass 342.14920
InChI InChI=1S/C18H19FN4O2/c1-11-3-5-12(6-4-11)14-15-17(20)21-10-22-18(15)23(7-2-8-24)16(14)13(25)9-19/h3-6,10,24H,2,7-9H2,1H3,(H2,20,21,22)
InChIKey IKLGYJACVCXYIL-UHFFFAOYSA-N
SMILES FCC(=O)C=1N(CCCO)C2=NC=NC(N)=C2C1C3=CC=C(C=C3)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing FMK (CHEBI:228606) is a pyrroles (CHEBI:26455)
IUPAC Name
1-[4-amino-7-(3-hydroxypropyl)-5-(4-methylphenyl)pyrrolo[2,3-d]pyrimidin-6-yl]-2-luoroethanone
Manual Xref Database
559262 ChemSpider
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