[(2R,3R,4S,5R,6R)-6-[(1S,2R)-2-chloro-1-{[(2S,4R)-4-ethyl-1-methylpyrrolidin-2-yl]formamido}propyl]-4,5-dihydroxy-2-(methylsulfanyl)oxan-3-yl]oxyphosphonic acid

CAS: 54887-31-9

Formula: C17H32ClN2O8PS

SMILES: [H][C@@]1(O[C@H](SC)[C@H](OP(O)(O)=O)[C@@H](O)[C@H]1O)[C@H](NC(=O)[C@@H]1C[C@@H](CC)CN1C)[C@@H](C)Cl

IUPAC: {[(2R,3R,4S,5R,6R)-6-[(1S,2R)-2-chloro-1-{[(2S,4R)-4-ethyl-1-methylpyrrolidin-2-yl]formamido}propyl]-4,5-dihydroxy-2-(methylsulfanyl)oxan-3-yl]oxy}phosphonic acid

InChI: InChI=1S/C17H32ClN2O8PS/c1-5-9-6-10(20(3)7-9)16(23)19-11(8(2)18)14-12(21)13(22)15(17(27-14)30-4)28-29(24,25)26/h8-15,17,21-22H,5-7H2,1-4H3,(H,19,23)(H2,24,25,26)/t8-,9-,10+,11-,12-,13+,14-,15-,17-/m1/s1

Composition: C (41.59%), H (6.57%), Cl (7.22%), N (5.71%), O (26.07%), P (6.31%), S (6.53%)

Molar Mass: 490.93

Atom Count: 62

Heavy Atom Count: 30