Monensin sodium (USP)

Properties Image MNX_ID MNXM62347 reference keggD:D05069 formula C31H52NaO9*2 global charge 1 mol weight   InChIKey   InChI   SMILES [*][C@H](OC)[C@H](C)[C@H]1O[C@@]2(CC[C@@](C)([C@H]3CC[C@@]([*])([C@@H]4O[C@@H]([C@H]5O[C@@](O)(CO)[C@H](C)C[C@@H]5C)C[C@@H]4C)O3)O2)C[C@H](O)[C@H]1C.[Na+] MNX internals InChI (mnx) InChI=1/C33H58O9.Na/c1-18-14-20(3)33(36,17-34)41-27(18)25-15-19(2)29(38-25)31(8)11-10-26(39-31)30(7)12-13-32(42-30)16-24(35)22(5)28(40-32)21(4)23(6)37-9;/h18-29,34-36H,10-17H2,1-9H3;/q;+1/t18-,19-,20+,21-,22+,23-,24-,25+,26+,27-,28+,29+,30-,31-,32+,33-;/m0./s1/i6+1,8+1; SMILES (mnx) [CH3:1][C@H:18]1[CH2:14][C@@H:20]([CH3:3])[C@@:33]([CH2:17][OH:34])([OH:36])[O:41][C@@H:27]1[C@H:25]1[CH2:15][C@H:19]([CH3:2])[C@H:29]([C@:31]2([13CH3:8])[CH2:11][CH2:10][C@H:26]([C@:30]3([CH3:7])[CH2:12][CH2:13][C@:32]4([CH2:16][C@H:24]([OH:35])[C@@H:22]([CH3:5])[C@@H:28]([C@@H:21]([CH3:4])[C@H:23]([13CH3:6])[O:37][CH3:9])[O:40]4)[O:42]3)[O:39]2)[O:38]1.[Na+:43]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0