Chemical Compound

methyl(1r,2r)-4-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-{[(2s,4as,5as,7s,9s,9ar,10ar)-2,9-dimethyl-3-oxooctahydro-2h,5ah-dipyrano[2,3-b:4',3'-e][1,4]dioxin-7-yl]oxy}-6-methyltetrahydro-2h-pyran-2-yl]oxy}-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate(non-preferred name)

CAS Registry Number 5935-65-9
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methyl(1r,2r)-4-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-{[(2s,4as,5as,7s,9s,9ar,10ar)-2,9-dimethyl-3-oxooctahydro-2h,5ah-dipyrano[2,3-b:4',3'-e][1,4]dioxin-7-yl]oxy}-6-methyltetrahydro-2h-pyran-2-yl]oxy}-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate(non-preferred name) 结构式
Primary record

methyl(1r,2r)-4-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-{[(2s,4as,5as,7s,9s,9ar,10ar)-2,9-dimethyl-3-oxooctahydro-2h,5ah-dipyrano[2,3-b:4',3'-e][1,4]dioxin-7-yl]oxy}-6-methyltetrahydro-2h-pyran-2-yl]oxy}-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate(non-preferred name)

库存
3,499 克
纯度
99.6 %
CAS
5935-65-9

化合物标识与属性

CAS
5935-65-9
PubChem CID
99299
SMILES
CC[C@]1(CC(C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C3=O)C(=CC=C4)O)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O[C@H]6C[C@H]7[C@@H]([C@@H](O6)C)O[C@H]8[C@@H](O7)CC(=O)[C@@H](O8)C)N(C)C)O
Canonical SMILES
CC[C@@]1(O)CC(O[C@H]2C[C@H](N(C)C)[C@H](O[C@H]3C[C@@H]4O[C@H]5CC(=O)[C@H](C)O[C@H]5O[C@@H]4[C@H](C)O3)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1C(=O)OC

名称与同义词

  • Aclacinomycin B1
  • Aclacinomycin B
  • Antibiotic MA 144B1
  • RefChem:109272
  • AC1L40SQ
  • CHEBI:218678
  • C36H45NO13
  • CID99299
  • AR-1J6244
  • LS-93903
  • methyl (1R,2R)-4-[(2R,4S,5S,6S)-4-(dimethylamino)-5-[[(1R,3R,5S,8S,10S,12S,14S)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl]oxy]-6-methyloxan-2-yl]oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
  • 1-Naphthacenecarboxylic acid, 4-(((2''',3''-anhydro)-O-3,6-dideoxy-alpha-L-erythro-hexopyranosyl-(1-4)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-, methyl ester,
  • 1-Naphthacenecarboxylic acid, 4-(((2''',3''-anhydro)-O-3,6-dideoxy-alpha-L-erythro-hexopyranosyl-(1-4)-2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7-trihydroxy-6,11-dioxo-, methyl ester, (1R-(1-alpha,2-beta,4-beta))-
  • 5935-65-9
  • Methyl (1R,2R)-4-(((2R,4S,5S,6S)-5-(((1R,3R,5S,8S,10S,12S,14S)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo(8.4.0.0,)tetradecan-12-yl)oxy)-4-(dimethylamino)-6-methyloxan-2-yl)oxy)-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylic acid
  • methyl (1R,2R)-4-((2R,4S,5S,6S)-4-(dimethylamino)-5-(((1R,3R,5S,8S,10S,12S,14S)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo(8.4.0.03,8)tetradecan-12-yl)oxy)-6-methyloxan-2-yl)oxy-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate
  • Methyl (1R,2R)-4-{[(2R,4S,5S,6S)-5-{[(1R,3R,5S,8S,10S,12S,14S)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0,]tetradecan-12-yl]oxy}-4-(dimethylamino)-6-methyloxan-2-yl]oxy}-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylic acid
  • methyl(1r,2r)-4-{[(2r,4s,5s,6s)-4-(dimethylamino)-5-{[(2s,4as,5as,7s,9s,9ar,10ar)-2,9-dimethyl-3-oxooctahydro-2h,5ah-dipyrano[2,3-b:4',3'-e][1,4]dioxin-7-yl]oxy}-6-methyltetrahydro-2h-pyran-2-yl]oxy}-2-ethyl-2,5,7-trihydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate(non-preferred name)