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HIT218848085
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HIT218848085
  • HIT ID:HIT218848085
  • Cas No:103963-38-8
  • 常用名:Ganoderic acid S
  • IUPAC:(2E,5S,6S)-6-[(1R,3aR,5aR,7R,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-1-yl]-5-(acetyloxy)-2-methylhept-2-enoic acid
    IUPAC:(2E,5S,6S)-6-[(1R,3aR,5aR,7R,9aS,11aR)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-1-yl]-5-(acetyloxy)-2-methylhept-2-enoic acid
  • InChI key:FRRMMEJOPQSLSE-HRGDRPPLSA-N
  • 分子式:C32H48O5
  • 分子量:512.731
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:[H][C@@]1(CC[C@@]2(C)C3=CC[C@@]4([H])C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@]12C)[C@H](C)[C@H](C\C=C(/C)C(O)=O)OC(C)=O
    SMILES:[H][C@@]1(CC[C@@]2(C)C3=CC[C@@]4([H])C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@]12C)[C@H](C)[C@H](C\C=C(/C)C(O)=O)OC(C)=O
  • Ganoderic acid S, a positional isomer of ganoderic acids, can be isolated from the fermented mycelia of Ganoderma lucidum. It can induce apoptosis in HeLa cells through the mitochondria pathway [1].
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    TargetMolSC
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