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  3. HIT214321323
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HIT214321323
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HIT214321323
  • HIT ID:HIT214321323
  • Cas No:1485692-21-4
  • 常用名:Dolutegravir O-β-D-Glucuronide
  • IUPAC:(2S,3S,4S,5R,6S)-6-{[(3S,7R)-13-{[(2,4-difluorophenyl)methyl]carbamoyl}-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.0^{3,8}]tetradeca-10,13-dien-11-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
    IUPAC:(2S,3S,4S,5R,6S)-6-{[(3S,7R)-13-{[(2,4-difluorophenyl)methyl]carbamoyl}-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.0^{3,8}]tetradeca-10,13-dien-11-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
  • InChI key:RSWVIGYRNQZNSD-DGPWBEAXSA-N
  • 分子式:C26H27F2N3O11
  • 分子量:595.509
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)c3C(=O)N1[C@H](C)CCO2
    SMILES:[H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)c3C(=O)N1[C@H](C)CCO2
  • Dolutegravir O-β-D-glucuronide is a metabolite of the HIV integrase inhibitor dolutegravir .1It is formed from dolutegravir primarily by the UDP-glucuronosyltransferase (UGT) isoform UGT1A1in vivobut is also metabolized by UGT1A9 in human liver and kidney microsomes and UGT1A3 in human intestinal microsomes.2,1
市场产品/服务共显示1个结果
  • 供应商
    TargetMolSC
    规格
    货期
    35日内发货
    纯度
    -
    ¥ 16,500.00
    1

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