Leucomycin V, 4(sup B),9-diacetate 3-propanoate

[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-10-acetyloxy-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate

Also Known As: 9,4''-Diacetyl-4''-depropionylmidecamycin|Leucomycin V, 4(sup B),9-diacetate 3-propanoate|[(4R,5S,6S,7R,9R,10R,11E,13E,16R)-10-acetyloxy-6-[(2S,3R,4R,5S,6R)-5-[(2S,4R,5S,6S)-5-acetyloxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate

Molecular Formula	C42H67NO16
Molecular Weight	841.446 g/mol
LogP	2.9481
Topological Polar Surface Area	212.12 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	17
Rotatable Bonds	12
Exact Mass	841.446
Monoisotopic Mass	841.446
Heavy Atoms	59
Complexity	1450.9177

Chemical Identifiers

CAS Number	65178-01-0
SMILES	CCC(=O)O[C@@H]1CC(=O)O[C@@H](C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)OC(=O)C)C