AR-1C7173

2-[(3-amino-2,4,6-trichlorophenyl)methyl]butanoic acid;14-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-8-ethyl-1-hydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione

Also Known As: 2-(3-amino-2,4,6-trichlorobenzyl)butanoic acid- 14-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2h-pyran-2-yl]oxy}-8-ethyl-1-hydroxy-12-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione(1:1)(non-preferred name)|Erythromycin, 9-deoxo-6,9-epoxy-9-hydroxy-, cyclic 11,12-carbonate, (9S)-, 3-amino-2,4,6-trichloro-alpha-ethylbenzenepropanoate (salt)

Molecular Formula	C49H77Cl3N2O16
Molecular Weight	1054.4338 g/mol
LogP	7.01
Topological Polar Surface Area	244.46 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	17
Rotatable Bonds	11
Exact Mass	1054.4338
Heavy Atoms	70
Complexity	2022.6

Chemical Identifiers

CAS Number	59246-33-2
SMILES	CCC1C2(C(C(C3(C(CC(O3)(C(C(C(C(C(=O)O1)C)OC4CC(C(C(O4)C)O)(C)OC)C)OC5C(C(CC(O5)C)N(C)C)O)C)C)O)C)OC(=O)O2)C.CCC(CC1=C(C(=C(C=C1Cl)Cl)N)Cl)C(=O)O