CHEBI:184688 - Macaridine

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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 Macaridine
ChEBI ID CHEBI:184688
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H13NO2
Net Charge 0
Average Mass 215.252
Monoisotopic Mass 215.09463
InChI InChI=1S/C13H13NO2/c15-10-12-6-7-14(16)9-13(12)8-11-4-2-1-3-5-11/h1-7,10,16H,8-9H2
InChIKey PHSAQLJHWJOCBJ-UHFFFAOYSA-N
SMILES ON1CC(CC2=CC=CC=C2)=C(C=C1)C=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Macaridine (CHEBI:184688) is a dihydropyridine (CHEBI:50075)
IUPAC Name
3-benzyl-1-hydroxy-2H-pyridine-4-carbaldehyde
Manual Xrefs Databases
552337 ChemSpider
HMDB0039455 HMDB
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