Name: Sancycline HCl
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212039108
Cas No:6625-20-3
常用名:Sancycline HCl
别名:NSC 51812 (as hydrochloride), GS-2147, GS2147, GS 2147, Bonomycin, 6-Demethyl-6-deoxytetracycline
别名:NSC 51812 (as hydrochloride), GS-2147, GS2147, GS 2147, Bonomycin, 6-Demethyl-6-deoxytetracycline
IUPAC:(4S,4aS,5aR,12aS)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride
IUPAC:(4S,4aS,5aR,12aS)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride
InChI key:NHHHLWBNBLFCSB-QKYUADJBSA-N

分子式:C21H23ClN2O7
分子量:450.87
氢键供体数 (HBD):5
氢键受体数 (HBA):8
LogP:-2.595938
SMILES:Cl.[H][C@@]12Cc3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2 |t:14,24|
SMILES:Cl.[H][C@@]12Cc3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2 |t:14,24|

Sancycline is a semi-synthetic tetracycline antibiotic that is more active than tetracycline against 339 strains of anaerobic bacteria (MIC90s = 1 and 32 μg/ml, respectively).

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