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Substance Name: Pibrozelesin hydrobromide [USAN]
RN: 148778-32-9
UNII: 0481JCC90T
InChIKey: YMALQNICPSISCA-GMUIIQOCSA-N

Classification Code

  • Antineoplastic

Molecular Formula

  • C32-H36-Br-N5-O8.Br-H

Molecular Weight

  • 779.4793
 
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Names and Synonyms

Name of Substance

  • Pibrozelesin hydrobromide [USAN]

Synonyms

  • 8-(Bromomethyl)-3,6,7,8-tetrahydro-2-methyl-4-(((4-methyl-1-piperazinyl)carbonyl)oxy)-6-((1,6,7-trimethoxy-1H-indol-2-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrole-1-carboxylic acid, methyl ester, monohydrobromide
  • KW-2189
  • Methyl (S)-8-(bromomethyl)-3,6,7,8-tetrahydro-4-hydroxy-2-methyl-6-((5,6,7-trimethoxyindol-2-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrole-1-carboxylate, 4-methyl-1-piperazinecarboxylate (ester), monohydrobromide
  • Pibrozelesin hydrobromide
  • UNII-0481JCC90T

Systematic Name

  • 8-(Bromomethyl)-3,6,7,8-tetrahydro-2-methyl-4-(((4-methyl-1-piperazinyl)carbonyl)oxy)-6-((1,6,7-trimethoxy-1H-indol-2-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrole-1-carboxylic acid,-, methyl ester, monohydrobromide

Registry Numbers

CAS Registry Number

  • 148778-32-9

FDA UNII

  • 0481JCC90T

System Generated Number

  • 0148778329

Molecular Formulas

Molecular Formula

  • C32-H36-Br-N5-O8.Br-H

Molecular Formula Fragments

  • Br-H
  • C32-H36-Br-N5-O8
  • COMPONENT

Structure Descriptors

InChI

1S/C32H36BrN5O8.BrH/c1-16-23(31(40)45-6)25-24-18(14-33)15-38(20(24)13-21(27(25)34-16)46-32(41)37-9-7-36(2)8-10-37)30(39)19-11-17-12-22(42-3)28(43-4)29(44-5)26(17)35-19;/h11-13,18,34-35H,7-10,14-15H2,1-6H3;1H/t18-;/m1./s1

InChIKey

YMALQNICPSISCA-GMUIIQOCSA-N

Smiles

Br.COC(=O)c1c(C)[nH]c2c(OC(=O)N3CCN(C)CC3)cc4N(C[C@@H](CBr)c4c12)C(=O)c5cc6cc(OC)c(OC)c(OC)c6[nH]5