Name: Vineomycin A1
Rating: 5 (10 reviews)

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sdf 文件

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HIT ID:HIT219251487
Cas No:78164-00-8
常用名:Vineomycin A1
别名:Vineomycin A1, OS-4742 A1
IUPAC:(3R,4aR,12bS)-4a,8,12b-trihydroxy-9-[(2R,4R,5S,6R)-4-hydroxy-6-methyl-5-{[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}oxan-2-yl]oxy}oxan-2-yl]-3-methyl-3-{[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}oxan-2-yl]oxy}-1,2,3,4,4a,7,12,12b-octahydrotetraphene-1,7,12-trione
IUPAC:(3R,4aR,12bS)-4a,8,12b-trihydroxy-9-[(2R,4R,5S,6R)-4-hydroxy-6-methyl-5-{[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}oxan-2-yl]oxy}oxan-2-yl]-3-methyl-3-{[(2S,5S,6S)-6-methyl-5-{[(2R,6S)-6-methyl-5-oxo-5,6-dihydro-2H-pyran-2-yl]oxy}oxan-2-yl]oxy}-1,2,3,4,4a,7,12,12b-octahydrotetraphene-1,7,12-trione
InChI key:YHSTYYHRDFATAQ-XURVNGJNSA-N

分子式:C49H58O18
分子量:934.985
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H]1O[C@H](CC[C@@H]1O[C@@H]1O[C@@H](C)C(=O)C=C1)O[C@@H]1[C@@H](C)O[C@H](C[C@H]1O)c1ccc2C(=O)C3=C(C=C[C@]4(O)C[C@](C)(CC(=O)[C@]34O)O[C@H]3CC[C@H](O[C@@H]4O[C@@H](C)C(=O)C=C4)[C@H](C)O3)C(=O)c2c1O
SMILES:C[C@@H]1O[C@H](CC[C@@H]1O[C@@H]1O[C@@H](C)C(=O)C=C1)O[C@@H]1[C@@H](C)O[C@H](C[C@H]1O)c1ccc2C(=O)C3=C(C=C[C@]4(O)C[C@](C)(CC(=O)[C@]34O)O[C@H]3CC[C@H](O[C@@H]4O[C@@H](C)C(=O)C=C4)[C@H](C)O3)C(=O)c2c1O

Vineomycin A1 (OS-4742 A1) 是一种抗革兰氏阳性菌的抗生素，来源于Streptomyces matensissubsp.vineus。此外，Vineomycin A1 在小鼠实验中展现了抗肿瘤活性，并有望应用于皮肤纤维化的研究。

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