Name: TQL-1055
Rating: 5 (10 reviews)

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HIT ID:HIT219136743
Cas No:2095876-40-5
常用名:TQL-1055
IUPAC:11-{[(2S,3R,4S,5R,6S)-6-[(4aR,5R,6aS,6bR,8aR,9S,10S,12aR,12bR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carbonyloxy]-5-{[(2S,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]carbamoyl}undecanoic acid
IUPAC:11-{[(2S,3R,4S,5R,6S)-6-[(4aR,5R,6aS,6bR,8aR,9S,10S,12aR,12bR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carbonyloxy]-5-{[(2S,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]carbamoyl}undecanoic acid
InChI key:CTNVWGJRCZGKAW-AMUHCMMCSA-N

分子式:C59H95NO20
分子量:1138.396
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CC(C)(C)CC[C@@]1([C@H](O)C[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)[C@@](C)(C=O)[C@]3([H])CC[C@@]12C)C(=O)O[C@@H]1O[C@H](CO)[C@H](NC(=O)CCCCCCCCCCC(O)=O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O
SMILES:[H][C@@]12CC(C)(C)CC[C@@]1([C@H](O)C[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)[C@@](C)(C=O)[C@]3([H])CC[C@@]12C)C(=O)O[C@@H]1O[C@H](CO)[C@H](NC(=O)CCCCCCCCCCC(O)=O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O

TQL-1055，作为皂苷佐剂QS-21的半合成衍生物，被广泛应用于预防性疫苗的佐剂中。针对流感抗原(influenza antigens)，TQL-1055展现出优异的增强效果。此外，TQL-1055与无细胞百日咳疫苗(aP)的结合，不仅具有良好的耐受性，还能显著提升小鼠和兔子对百日咳毒素(PT)的抗体反应。因其潜在的应用价值，TQL-1055目前正被研究用于治疗慢性乙型肝炎。

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