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Substance Name: Distamycin A4
RN: 13696-04-3
InChIKey: JIZIWJXHFAWHNY-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C28-H33-N11-O5.Cl-H

Molecular Weight

  • 603.6407
 
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Names and Synonyms

Results Name

  • Distamycin A4

Synonyms

  • Distamycin A/4
  • N,4':N,4'':N'',4'''-Quater(pyrrole-2-carboxamide), N'''-(2-amidinoethyl)-4-formamido-1,1',1'',1'''-tetramethyl-

Systematic Names

  • 1H-Pyrrole-2-carboxamide, N-(5-(((5-(((3-amino-3-iminopropyl)amino)carbonyl)-1-methyl-1H-pyrrol-3-yl)amino)carbonyl)-1-methyl-1H-pyrrol-3-yl)-4-(((4-(formylamino)-1-methyl-1H-pyrrol-2-yl)carbonyl)amino)-1-methyl-
  • N,4':N',4'':N'',4'''-Tetra(pyrrole-2-carboxamide), N'''-(2-amidinoethyl)-4-formamido-1,1',1'',1'''-tetramethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 13696-04-3

System Generated Number

  • 0013696043

Molecular Formulas

Molecular Formula

  • C28-H33-N11-O5.Cl-H

Molecular Formula Fragments

  • C28-H33-N11-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H33N11O5/c1-36-11-16(32-15-40)7-21(36)26(42)34-18-9-23(38(3)13-18)28(44)35-19-10-22(39(4)14-19)27(43)33-17-8-20(37(2)12-17)25(41)31-6-5-24(29)30/h7-15H,5-6H2,1-4H3,(H3,29,30)(H,31,41)(H,32,40)(H,33,43)(H,34,42)(H,35,44)

InChIKey

JIZIWJXHFAWHNY-UHFFFAOYSA-N

Smiles

Cn1cc(cc1C(=O)Nc2cc(n(c2)C)C(=O)Nc3cc(n(c3)C)C(=O)Nc4cc(n(c4)C)C(=O)NCCC(=N)N)NC=O