Name: Roxithromycin
Rating: 5 (10 reviews)

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类似物检索

HIT ID:HIT104892223
Cas No:80214-83-1
常用名:Roxithromycin
别名:罗红霉素, RU-28965, Roxl-150
IUPAC:(10E)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-10-(2,4,7-trioxa-1-azaoctan-1-ylidene)-1-oxacyclotetradecan-2-one
IUPAC:(10E)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-10-(2,4,7-trioxa-1-azaoctan-1-ylidene)-1-oxacyclotetradecan-2-one
InChI key:RXZBMPWDPOLZGW-FEMONOMJSA-N

分子式:C41H76N2O15
分子量:837.058
氢键供体数 (HBD):5
氢键受体数 (HBA):15
LogP:2.29
SMILES:CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)(O)CC(C)\C(=N/OCOCCOC)C(C)C(O)C1(C)O
SMILES:CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)(O)CC(C)\C(=N/OCOCCOC)C(C)C(O)C1(C)O

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