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

Acetoacetyl-ACP

Properties Image MNX_ID MNXM1563636 reference vmhM:butACPox vmhM:butACPox formula C15H25N2O9PS* global charge -1 mol weight 440.411 InChIKey   InChI   SMILES [*]OP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(C)=O MNX internals InChI (mnx) InChI=1/C16H29N2O9PS/c1-11(19)9-13(21)29-8-7-17-12(20)5-6-18-15(23)14(22)16(2,3)10-27-28(24,25)26-4/h14,22H,5-10H2,1-4H3,(H,17,20)(H,18,23)(H,24,25)/t14-/m0/s1/i4+1 SMILES (mnx) [CH3:1][C:11]([CH2:9][C:13](=[O:21])[S:29][CH2:8][CH2:7][NH:17][C:12]([CH2:5][CH2:6][NH:18][C:15]([C@@H:14]([C:16]([CH3:2])([CH3:3])[CH2:10][O:27][P:28](=[O:24])([OH:25])[O:26][13CH3:4])[OH:22])=[O:23])=[O:20])=[O:19]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
vmhM:butACPox vmhM:butACPox vmhmetabolite:butACPox vmhmetabolite:butACPox	Acetoacetyl-ACP
vmhM:HC01587 vmhM:HC01587 vmhM:aaacp vmhM:aaacp vmhM:actACP vmhM:actACP vmhM:but3oxACP vmhM:but3oxACP vmhM:M_butACPox	secondary/obsolete/fantasy identifier