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Substance Name: Butanediamide, N1-(5-((3-((4-((3-aminopropyl)amino)butyl)amino)-1-oxopropyl)amino)pentyl)-2-(((2,4-dihydroxyphenyl)acetyl)amino)-, (2S)-
RN: 112163-33-4
InChIKey: SJLRBGDPTALRDM-QFIPXVFZSA-N

Molecular Formula

  • C27-H47-N7-O6

Molecular Weight

  • 565.711
 
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Names and Synonyms

  • Butanediamide, N1-(5-((3-((4-((3-aminopropyl)amino)butyl)amino)-1-oxopropyl)amino)pentyl)-2-(((2,4-dihydroxyphenyl)acetyl)amino)-, (2S)-

Registry Numbers

CAS Registry Number

  • 112163-33-4

System Generated Number

  • 0112163334

Structure Descriptors

InChI

1S/C27H47N7O6/c28-10-6-13-30-11-4-5-12-31-16-9-25(38)32-14-2-1-3-15-33-27(40)22(19-24(29)37)34-26(39)17-20-7-8-21(35)18-23(20)36/h7-8,18,22,30-31,35-36H,1-6,9-17,19,28H2,(H2,29,37)(H,32,38)(H,33,40)(H,34,39)/t22-/m0/s1

InChIKey

SJLRBGDPTALRDM-QFIPXVFZSA-N

Smiles

c1cc(CC(N[C@@H](CC(N)=O)C(NCCCCCNC(CCNCCCCNCCCN)=O)=O)=O)c(cc1O)O