**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

a CMP-N-acyl-neuraminate

Properties Image MNX_ID MNXM733195 reference metacycM:CPD-189 formula C19H26N4O16P* global charge -2 mol weight   InChIKey   InChI   SMILES [*]C(=O)N[C@H]1[C@H]([C@H](O)[C@H](O)CO)OC(OP(=O)([O-])OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)(C(=O)[O-])C[C@@H]1O MNX internals InChI (mnx) InChI=1/C20H31N4O16P/c1-7(26)22-12-8(27)4-20(18(32)33,39-16(12)13(29)9(28)5-25)40-41(35,36)37-6-10-14(30)15(31)17(38-10)24-3-2-11(21)23-19(24)34/h2-3,8-10,12-17,25,27-31H,4-6H2,1H3,(H,22,26)(H,32,33)(H,35,36)(H2,21,23,34)/t8-,9+,10+,12+,13+,14+,15+,16+,17+,20?/m0/s1/i1+1 SMILES (mnx) [13cH:1]1[cH:2][n:23]([CH:16]2[CH:14]([OH:30])[C@@H:13]([OH:29])[C@H:9]([CH2:5][O:36][O:40](=[O:34])([OH:35])[O:39][C:19]3([C:17](=[O:31])[OH:32])[CH2:3][C@@H:7]([OH:26])[C@H:11]([NH:21][C:6](=[O:25])[PH2:41])[C@H:15]([CH:12]([C@@H:8]([CH2:4][NH2:24])[OH:27])[OH:28])[O:38]3)[O:37]2)[c:18](=[O:33])[n:22][c:10]1[CH3:20]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:CPD-189 metacycM:CPD-189	a CMP-N-acyl-neuraminate
seed.compound:cpd24360 seedM:cpd24360	CPD-189
seedM:M_cpd24360	secondary/obsolete/fantasy identifier