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

ACYL-COA

Properties Image MNX_ID MNXM491059 reference seedM:cpd22234 formula C22H31N7O17P3S* global charge -4 mol weight   InChIKey   InChI   SMILES [*]C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-] MNX internals InChI (mnx)   SMILES (mnx) [*:1][C:2](=[O:3])[S:4][CH2:5][CH2:6][NH:7][C:8](=[O:9])[CH2:10][CH2:11][NH:12][C:13](=[O:14])[C@H:15]([OH:16])[C:17]([CH3:18])([CH3:19])[CH2:20][O:21][P:22](=[O:23])([OH:24])[O:25][P:26](=[O:27])([OH:28])[O:29][CH2:30][C@H:31]1[O:32][C@@H:33]([N:34]2[CH:35]=[N:36][C:37]3=[C:38]([NH2:39])[N:40]=[CH:41][N:42]=[C:43]23)[C@H:44]([OH:45])[C@@H:46]1[O:47][P:48](=[O:49])([OH:50])[OH:51]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 54 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
seed.compound:cpd22234 seedM:cpd22234	ACYL-COA
seedM:M_cpd22234	secondary/obsolete/fantasy identifier