Catalog Number:
AG008M6K
Chemical Name:
Ciclopirox beta-D-Glucuronide
CAS Number:
79419-54-8
Molecular Formula:
C18H25NO8
Molecular Weight:
383.3930
MDL Number:
MFCD08063647
IUPAC Name:
(3R,6R)-6-(2-cyclohexyl-4-methyl-6-oxopyridin-1-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChI:
InChI=1S/C18H25NO8/c1-9-7-11(10-5-3-2-4-6-10)19(12(20)8-9)27-18-15(23)13(21)14(22)16(26-18)17(24)25/h7-8,10,13-16,18,21-23H,2-6H2,1H3,(H,24,25)/t13?,14-,15?,16?,18-/m1/s1
InChI Key:
RRBPTSPRUYTJLL-OIJGMWSASA-N
SMILES:
OC(=O)C1O[C@H](On2c(=O)cc(cc2C2CCCCC2)C)C(C([C@H]1O)O)O
