Chemical Compound

iron(2+)(2-amino-3-{[1-(4-amino-6-{[1-{[3-({4-[(azanidylcarbonyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl}oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl]oxy}-3-({5-[(1-{[2-(4-{[3-(dimethylsulfonio)propyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]amino}-3-hydroxy-1-oxobutan-2-yl)amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl}amino)-1-(1h-imidazol-5-yl)-3-oxopropan-2-yl]carbamoyl}-5-methylpyrimidin-2-yl)-3-azanidyl-3-oxopropyl]amino}propanoyl)azanide(non-preferred name)

CAS Registry Number 71801-37-1
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iron(2+)(2-amino-3-{[1-(4-amino-6-{[1-{[3-({4-[(azanidylcarbonyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl}oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl]oxy}-3-({5-[(1-{[2-(4-{[3-(dimethylsulfonio)propyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]amino}-3-hydroxy-1-oxobutan-2-yl)amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl}amino)-1-(1h-imidazol-5-yl)-3-oxopropan-2-yl]carbamoyl}-5-methylpyrimidin-2-yl)-3-azanidyl-3-oxopropyl]amino}propanoyl)azanide(non-preferred name) 结构式
Primary record

iron(2+)(2-amino-3-{[1-(4-amino-6-{[1-{[3-({4-[(azanidylcarbonyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl}oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl]oxy}-3-({5-[(1-{[2-(4-{[3-(dimethylsulfonio)propyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]amino}-3-hydroxy-1-oxobutan-2-yl)amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl}amino)-1-(1h-imidazol-5-yl)-3-oxopropan-2-yl]carbamoyl}-5-methylpyrimidin-2-yl)-3-azanidyl-3-oxopropyl]amino}propanoyl)azanide(non-preferred name)

库存
3,073 克
纯度
99.3 %
CAS
71801-37-1

化合物标识与属性

CAS
71801-37-1
PubChem CID
124116
SMILES
CC1=C(N=C(N=C1N)C(CC(=N)[O-])NCC(C(=N)[O-])N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=N)[O-])O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCC[S+](C)C)O.[Fe+2]
Canonical SMILES
Cc1c(N)nc(C(CC(=N)[O-])NCC(N)C(=N)[O-])nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCC[S+](C)C)cs2)cs1)C(C)O)C(OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(OC(=N)[O-])C1O)c1cnc[nH]1.[Fe+2]

名称与同义词

  • AC1L3XW1
  • Bleomycin-iron(II) complex
  • Bleomycin A2-iron(2+)complex
  • Bleomycin-iron(2+) complex
  • AR-1J2523
  • CID124116
  • (N1-(3-(Dimethylsulfonio)propyl)bleomycinamidato)iron(2+)
  • Iron(2+), (N1-(3-(dimethylsulfonio)propyl)bleomycinamidato)-
  • 71801-37-1
  • 3-[4-amino-6-[[1-[3-[3,5-dihydroxy-6-(hydroxymethyl)-4-(C-oxidocarbonimidoyl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[[5-[[1-[2-[4-[4-(3-dimethylsulfoniopropylcarbamoyl)-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropan-2-yl]carbamoyl]-5-methylpyrimidin-2-yl]-3-[(2-amino-3-imino-3-oxidopropyl)amino]propanimidate; iron(2+)
  • 7460-35-7
  • iron(2+)(2-amino-3-{[1-(4-amino-6-{[1-{[3-({4-[(azanidylcarbonyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl}oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2h-pyran-2-yl]oxy}-3-({5-[(1-{[2-(4-{[3-(dimethylsulfonio)propyl]carbamoyl}-2,4'-bi-1,3-thiazol-2'-yl)ethyl]amino}-3-hydroxy-1-oxobutan-2-yl)amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl}amino)-1-(1h-imidazol-5-yl)-3-oxopropan-2-yl]carbamoyl}-5-methylpyrimidin-2-yl)-3-azanidyl-3-oxopropyl]amino}propanoyl)azanide(non-preferred name)