CHEBI:107548 - 3-[[1,3-benzodioxol-5-ylmethyl-[[1-(2-furanylmethyl)-5-tetrazolyl]methyl]amino]methyl]-6-methyl-1H-quinolin-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[[1,3-benzodioxol-5-ylmethyl-[[1-(2-furanylmethyl)-5-tetrazolyl]methyl]amino]methyl]-6-methyl-1H-quinolin-2-one
ChEBI ID CHEBI:107548
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H24N6O4
Net Charge 0
Average Mass 484.508
Monoisotopic Mass 484.18590
InChI InChI=1S/C26H24N6O4/c1-17-4-6-22-19(9-17)11-20(26(33)27-22)13-31(12-18-5-7-23-24(10-18)36-16-35-23)15-25-28-29-30-32(25)14-21-3-2-8-34-21/h2-11H,12-16H2,1H3,(H,27,33)
InChIKey KYIWUANOGAVPOM-UHFFFAOYSA-N
SMILES CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC4=C(C=C3)OCO4)CC5=NN=NN5CC6=CC=CO6
ChEBI Ontology
Outgoing 3-[[1,3-benzodioxol-5-ylmethyl-[[1-(2-furanylmethyl)-5-tetrazolyl]methyl]amino]methyl]-6-methyl-1H-quinolin-2-one (CHEBI:107548) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-18904 LINCS
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