Omiganan

Iupac Name

(S)-N-((S)-1-(((S)-1-((S)-2-((3S,6S,9S,12S)-3-((1H-indol-3-yl)methyl)-16-amino-6,9-bis(3-guanidinopropyl)-1,4,7,10-tetrahydroxy-12-(hydroxy(imino)methyl)-2,5,8,11-tetraazahexadeca-1,4,7,10-tetraen-1-yl)pyrrolidin-1-yl)-3-(1H-indol-3-yl)-1-oxopropan-2-yl)imino)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl)-1-((S)-2-(((S)-2-(((S)-2-(((2S,3S)-2-amino-1-hydroxy-3-methylpentylidene)amino)-1-hydroxy-4-methylpentylidene)amino)-5-guanidino-1-hydroxypentylidene)amino)-3-(1H-indol-3-yl)propanoyl)pyrrolidine-2-carbimidic acid

Inchi Code

1S/C90H127N27O12/c1-5-51(4)75(92)85(127)113-68(41-50(2)3)80(122)109-67(32-18-38-102-90(98)99)79(121)114-71(44-54-48-105-62-27-12-8-23-58(54)62)86(128)116-39-19-34-74(116)84(126)112-70(43-53-47-104-61-26-11-7-22-57(53)61)82(124)115-72(45-55-49-106-63-28-13-9-24-59(55)63)87(129)117-40-20-33-73(117)83(125)111-69(42-52-46-103-60-25-10-6-21-56(52)60)81(123)110-66(31-17-37-101-89(96)97)78(120)108-65(30-16-36-100-88(94)95)77(119)107-64(76(93)118)29-14-15-35-91/h6-13,21-28,46-51,64-75,103-106H,5,14-20,29-45,91-92H2,1-4H3,(H2,93,118)(H,107,119)(H,108,120)(H,109,122)(H,110,123)(H,111,125)(H,112,126)(H,113,127)(H,114,121)(H,115,124)(H4,94,95,100)(H4,96,97,101)(H4,98,99,102)/t51-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-/m0/s1

InChI key

MVPAMLBUDIFYGK-BHDRXCTLSA-N