Chemical Compound

Bleomycin M5196

CAS Registry Number 69227-45-8
Bleomycin M5196 chemical structure
Primary Record

Bleomycin M5196

In stock
8,562 g
Purity
98.3 %
CAS
69227-45-8

Compound Identifiers & Properties

CAS
69227-45-8
PubChem CID
101826979
SMILES
CC1=C(N=C(N=C1N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C(=O)N[C@@H]([C@H](C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)N[C@H](C)[C@H]([C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCN(C)CCCN=C(CC7CCC(CC7)Cl)N)O
Canonical SMILES
Cc1c(N)nc([C@H](CC(N)=O)NC[C@H](N)C(N)=O)nc1C(=O)N[C@H](C(=O)N[C@H](C)[C@@H](O)[C@H](C)C(=O)N[C@H](C(=O)NCCc1nc(-c2nc(C(=O)NCCCN(C)CCCN=C(N)CC3CCC(Cl)CC3)cs2)cs1)[C@@H](C)O)[C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]1O)c1cnc[nH]1

Names & Synonyms

  • Bleomycin M5196
  • UNII-RVR2EK66PE
  • RVR2EK66PE
  • Bleomycin M-5196
  • CCRIS 1245
  • RefChem:120645
  • BLEOMYCIN M 5196
  • DTXSID101031887
  • 69227-45-8
  • J247.859E
  • Q27288306
  • BLEOMYCINAMIDE, N1-(3-((3-((2-(4-CHLOROCYCLOHEXYL)-1-IMINOETHYL)AMINO)PROPYL)METHYLAMINO)PROPYL)-
  • (2R,3S,4S,5R,6R)-2-{[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-({6-amino-2-[(1S)-1-{[(2S)-2-amino-2-carbamoylethyl]amino}-2-carbamoylethyl]-5-methylpyrimidin-4-yl}formamido)-2-{[(2R,3S,4S)-4-{[(1S,2R)-1-({2-[4-(4-{[3-({3-[2-(4-chlorocyclohexyl)ethanimidamido]propyl}(methyl)amino)propyl]carbamoyl}-1,3-thiazol-2-yl)-1,3-thiazol-2-yl]ethyl}carbamoyl)-2-hydroxypropyl]carbamoyl}-3-hydroxy-4-methylbutan-2-yl]carbamoyl}-1-(1H-imidazol-4-yl)ethoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl carbamate
  • N1-[3-[[3-[[2-(4-Chlorocyclohexyl)-1-iminoethyl]amino]propyl]methylamino]propyl]bleomycinamide