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Substance Name: Butanediamide, N4-(5-(acetylamino)-1-((methylamino)carbonyl)pentyl)-N1-hydroxy-2-(((4-hydroxyphenyl)thio)methyl)-3-(2-methylpropyl)-, (2S-(N4(R*),2R*,3S*))-
RN: 157726-04-0
InChIKey: JXPAEGFEJLMUOM-HKBOAZHASA-N

Molecular Formula

  • C24-H38-N4-O6-S

Molecular Weight

  • 510.6522
 
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Names and Synonyms

Synonyms

  • BB 2116
  • BB-2116
  • BB2116

Systematic Name

  • Butanediamide, N4-(5-(acetylamino)-1-((methylamino)carbonyl)pentyl)-N1-hydroxy-2-(((4-hydroxyphenyl)thio)methyl)-3-(2-methylpropyl)-, (2S-(N4(R*),2R*,3S*))-

Registry Numbers

CAS Registry Number

  • 157726-04-0

System Generated Number

  • 0157726040

Structure Descriptors

InChI

1S/C24H38N4O6S/c1-15(2)13-19(20(23(32)28-34)14-35-18-10-8-17(30)9-11-18)22(31)27-21(24(33)25-4)7-5-6-12-26-16(3)29/h8-11,15,19-21,30,34H,5-7,12-14H2,1-4H3,(H,25,33)(H,26,29)(H,27,31)(H,28,32)/t19-,20+,21+/m1/s1

InChIKey

JXPAEGFEJLMUOM-HKBOAZHASA-N

Smiles

CC(C)C[C@H]([C@H](CSc1ccc(cc1)O)C(=O)NO)C(=O)N[C@@H](CCCCNC(=O)C)C(=O)NC