Analyte Name

2-Dechloro-N-(prop-1-en-1-yl) Clindamycin

CAS Number

198080-64-7

Molecular Formula

C18 H32 N2 O5 S

Molecular Weight

388.522

Accurate Mass

388.203

SMILES

CCC[C@@H]1C[C@H](N(C)C1)C(=O)N\C(=C/C)\[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O

InChI

InChI=1S/C18H32N2O5S/c1-5-7-10-8-12(20(3)9-10)17(24)19-11(6-2)16-14(22)13(21)15(23)18(25-16)26-4/h6,10,12-16,18,21-23H,5,7-9H2,1-4H3,(H,19,24)/b11-6-/t10-,12+,13+,14-,15-,16-,18-/m1/s1

IUPAC

(2S,4R)-1-methyl-4-propyl-N-[(Z)-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]prop-1-enyl]pyrrolidine-2-carboxamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat