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HIT219599977
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HIT219599977
  • HIT ID:HIT219599977
  • Cas No:147657-35-0
  • 常用名:Cinerubin R
  • IUPAC:methyl 4-{[4-(dimethylamino)-6-methyl-5-({6-methyl-5-[(6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl)oxy]oxan-2-yl}oxy)oxan-2-yl]oxy}-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate
    IUPAC:methyl 4-{[4-(dimethylamino)-6-methyl-5-({6-methyl-5-[(6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl)oxy]oxan-2-yl}oxy)oxan-2-yl]oxy}-2-ethyl-2,5,7,10-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate
  • InChI key:HIMMZWQWBNOPJH-UHFFFAOYSA-N
  • 分子式:C42H51NO15
  • 分子量:809.862
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CCC1(O)CC(OC2CC(C(OC3CCC(OC4OC(C)C(=O)C=C4)C(C)O3)C(C)O2)N(C)C)c2c(O)c3C(=O)c4c(O)ccc(O)c4C(=O)c3cc2C1C(=O)OC
    SMILES:CCC1(O)CC(OC2CC(C(OC3CCC(OC4OC(C)C(=O)C=C4)C(C)O3)C(C)O2)N(C)C)c2c(O)c3C(=O)c4c(O)ccc(O)c4C(=O)c3cc2C1C(=O)OC
  • Cinerubin R 对抗革兰氏阳性菌有活性,并能抑制肿瘤细胞,其对多药耐药(MDR)细胞的抑制效果与普通细胞一致。
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