CHEBI:176433 - Jenamidine A

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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 Jenamidine A
ChEBI ID CHEBI:176433
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C13H18N2O3
Net Charge 0
Average Mass 250.298
Monoisotopic Mass 250.13174
InChI InChI=1S/C13H18N2O3/c1-8(5-9(2)16)11-7-13(18)15-4-3-10(17)6-12(15)14-11/h5,7,9,12,14,16H,3-4,6H2,1-2H3/b8-5+
InChIKey AKWHGMWEGVKZON-VMPITWQZSA-N
SMILES C/C(=C\C(C)O)/C1=CC(N2CCC(CC2N1)=O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid960) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing Jenamidine A (CHEBI:176433) is a pyridopyrimidine (CHEBI:38932)