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

malonyl-[ACPI domain within CurA polyketide synthase]

Properties Image MNX_ID MNXM1562971 reference metacycM:Malonyl-CurA-ACPI-Domain formula C17H26N3O11PS*2 global charge -2 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC(=O)[O-])C([*])=O MNX internals InChI (mnx) InChI=1/C19H34N3O11PS/c1-12(23)13(20-4)10-32-34(30,31)33-11-19(2,3)17(28)18(29)22-6-5-14(24)21-7-8-35-16(27)9-15(25)26/h13,17,20,28H,5-11H2,1-4H3,(H,21,24)(H,22,29)(H,25,26)(H,30,31)/t13-,17-/m0/s1/i1+1,4+1 SMILES (mnx) [13CH2:1]([C:2](=[13CH2:4])[CH2:7][CH2:13][CH2:12][CH2:19][C:15]([CH2:10][CH2:11][NH:20][C:17]([C@H:16]([C:18]([CH3:8])([CH3:9])[CH2:14][O:24][O:25]([O:33][O:26][O:27]([O:28]([OH:29])=[O:31])[O:30][OH:32])([PH2:34])=[S:35])[NH2:22])=[O:23])=[NH:21])[C:3](=[CH2:5])[CH3:6]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:Malonyl-CurA-ACPI-Domain metacycM:Malonyl-CurA-ACPI-Domain	malonyl-[ACPI domain within CurA polyketide synthase]