Name: Kitasamycin tartrate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212687649
Cas No:37280-56-1
常用名:Kitasamycin tartrate
别名:Leucomycin tartrate
IUPAC:2,3-dihydroxybutanedioic acid; 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-{[(2S,3R,4R,5S,6R)-4-(dimethylamino)-3-hydroxy-5-{[(2R,5S,6R)-5-hydroxy-4,4,6-trimethyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
IUPAC:2,3-dihydroxybutanedioic acid; 2-[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-6-{[(2S,3R,4R,5S,6R)-4-(dimethylamino)-3-hydroxy-5-{[(2R,5S,6R)-5-hydroxy-4,4,6-trimethyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-4,10-dihydroxy-5-methoxy-9,16-dimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]acetaldehyde
InChI key:LCDBILLRZFJKMN-RKYMYSRXSA-N

分子式:C40H67NO18
分子量:849.965
氢键供体数 (HBD):4
氢键受体数 (HBA):12
LogP:2.0730515
SMILES:OC(C(O)C(O)=O)C(O)=O.CO[C@H]1[C@H](O)CC(=O)O[C@H](C)C\C=C\C=C\[C@H](O)[C@H](C)C[C@H](CC=O)[C@@H]1O[C@@H]1O[C@H](C)[C@@H](O[C@@H]2CC(C)(C)[C@H](O)[C@@H](C)O2)[C@@H]([C@H]1O)N(C)C |t:21,23|
SMILES:OC(C(O)C(O)=O)C(O)=O.CO[C@H]1[C@H](O)CC(=O)O[C@H](C)C\C=C\C=C\[C@H](O)[C@H](C)C[C@H](CC=O)[C@@H]1O[C@@H]1O[C@H](C)[C@@H](O[C@@H]2CC(C)(C)[C@H](O)[C@@H](C)O2)[C@@H]([C@H]1O)N(C)C |t:21,23|

Kitasamycin tartrate, a macrolide antibiotic produced by Streptomyces kitasatoensis, has a wide spectrum of antimicrobial activity.

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