Record Information
public_id FDB018638
Chemical Information
name Wybutoxine
description Constit. of phenylalanine tRNA of beef, chicken, calf and rat livers
cas_number 36238-44-5
Properties
created_at 2010-04-08 22:13:50
updated_at 2013-08-28 07:53:11
moldb_smiles COC(=O)NC(C(CC1=C(C)N=C2N1C(=O)C1=C(N=CN1)N2C)OO)C(=O)OC
moldb_formula C16H20N6O7
moldb_average_mass 408.366
moldb_inchi InChI=1S/C16H20N6O7/c1-7-8(5-9(29-26)10(14(24)27-3)20-16(25)28-4)22-13(23)11-12(18-6-17-11)21(2)15(22)19-7/h6,9-10,26H,5H2,1-4H3,(H,17,18)(H,20,25)
moldb_mono_mass 408.139347024
moldb_inchikey InChIKey=FRYWGCQTDZARGT-UHFFFAOYSA-N
moldb_iupac methyl 4-{4,6-dimethyl-9-oxo-1H,4H,9H-imidazo[1,2-a]purin-7-yl}-3-hydroperoxy-2-[(methoxycarbonyl)amino]butanoate
Structure Thumb
Synonyms
Synonym Source
Peroxy-y-base biospider
Methyl 4,9-dihydro-b-hydroperoxy-a-[(methoxycarbonyl)amino]-4,6-dimethyl-9-oxo-1H-imidazo[1,2-a]purine-7-butanoate, 9CI db_source
Peroxywybutine db_source