CHEBI:111382 - 6-methoxy-3-[[2-oxolanylmethyl-[1-[1-(phenylmethyl)-5-tetrazolyl]propyl]amino]methyl]-1H-quinolin-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-methoxy-3-[[2-oxolanylmethyl-[1-[1-(phenylmethyl)-5-tetrazolyl]propyl]amino]methyl]-1H-quinolin-2-one
ChEBI ID CHEBI:111382
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H32N6O3
Net Charge 0
Average Mass 488.582
Monoisotopic Mass 488.25359
InChI InChI=1S/C27H32N6O3/c1-3-25(26-29-30-31-33(26)16-19-8-5-4-6-9-19)32(18-23-10-7-13-36-23)17-21-14-20-15-22(35-2)11-12-24(20)28-27(21)34/h4-6,8-9,11-12,14-15,23,25H,3,7,10,13,16-18H2,1-2H3,(H,28,34)
InChIKey GGNAEMSQXQYFTF-UHFFFAOYSA-N
SMILES CCC(C1=NN=NN1CC2=CC=CC=C2)N(CC3CCCO3)CC4=CC5=C(C=CC(=C5)OC)NC4=O
ChEBI Ontology
Outgoing 6-methoxy-3-[[2-oxolanylmethyl-[1-[1-(phenylmethyl)-5-tetrazolyl]propyl]amino]methyl]-1H-quinolin-2-one (CHEBI:111382) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-22838 LINCS
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