Pirlimycin Hydrochloride

(2S,4R)-N-[2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide;hydrate;hydrochloride

Also Known As: Pirlimycin Hydrochloride|KST-1A8387|AN-5687|(2s,4r)-n-[2-chloro-1-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-4-ethyl-piperidine-2-carboxamide hydrate hydrochloride|(2S,4R)-N-[2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide hydrate hydrochloride|Methyl 7-chloro-6,7,8-trideoxy-6-({[(2S,4R)-4-ethylpiperidin-2-yl](hydroxy)methylidene}amino)-1-thio-alpha-D-galacto-octopyranoside--hydrogen chloride--water (1/1/1)|Methyl 7-chloro-6,7,8-trideoxy-6-{[(4-ethylpiperidin-2-yl)(hydroxy)methylidene]amino}-1-thiooctopyranoside--hydrogen chloride--water (1/1/1)

Molecular Formula	C17H34Cl2N2O6S
Molecular Weight	464.15146 g/mol
LogP	-0.36
Topological Polar Surface Area	142.55 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	464.15146
Heavy Atoms	28
Complexity	476.9

Chemical Identifiers

CAS Number	77495-92-2
SMILES	CC[C@@H]1CCN[C@@H](C1)C(=O)NC([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)C(C)Cl.O.Cl