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HIT219619380
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HIT219619380
  • HIT ID:HIT219619380
  • Cas No:65423-08-7
  • 常用名:15-Deoxy-15-oxolankamycin
  • IUPAC:6-{[12-(acetyloxy)-9-hydroxy-6-[(3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxo-14-(3-oxobutan-2-yl)-1-oxacyclotetradecan-4-yl]oxy}-4-methoxy-2,4-dimethyloxan-3-yl acetate
    IUPAC:6-{[12-(acetyloxy)-9-hydroxy-6-[(3-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxo-14-(3-oxobutan-2-yl)-1-oxacyclotetradecan-4-yl]oxy}-4-methoxy-2,4-dimethyloxan-3-yl acetate
  • InChI key:InChIKey=CUKCMFKBUKDACS-UHFFFAOYSA-N
  • 分子式:C42H70O16
  • 分子量:831.006
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:COC1CC(C)OC(OC2C(C)CC(C)(O)C(=O)C(C)C(OC(C)=O)C(C)C(OC(=O)C(C)C(OC3CC(C)(OC)C(OC(C)=O)C(C)O3)C2C)C(C)C(C)=O)C1O
    SMILES:COC1CC(C)OC(OC2C(C)CC(C)(O)C(=O)C(C)C(OC(C)=O)C(C)C(OC(=O)C(C)C(OC3CC(C)(OC)C(OC(C)=O)C(C)O3)C2C)C(C)C(C)=O)C1O
  • 15-Deoxy-15-oxolankamycin 展现微弱的抗革兰氏阳性菌活性。
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    TargetMolSC
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