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

L-alanyl-[AmbB non-ribosomal peptide synthase]

Properties Image MNX_ID MNXM1089769 reference metacycM:L-Alanyl-AmbB formula C17H31N4O9PS*2 global charge 0 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)[C@H](C)[NH3+])C([*])=O MNX internals InChI (mnx) InChI=1/C19H37N4O9PS/c1-12(20)18(28)34-9-8-22-15(25)6-7-23-17(27)16(26)19(3,4)11-32-33(29,30)31-10-14(21-5)13(2)24/h12,14,16,21,26H,6-11,20H2,1-5H3,(H,22,25)(H,23,27)(H,29,30)/t12-,14-,16-/m0/s1/i2+1,5+1 SMILES (mnx) [CH3:1][C:11]([13CH3:2])([CH2:7][CH2:17][C:18]([O:27][NH:20][N:21]([N:22]([NH2:23])=[O:25])[O:24][OH:26])([OH:28])=[O:29])[C@H:9]([C:10]([CH2:13][CH2:4][CH2:3][C:8]([CH2:12][13CH2:5][CH2:6][CH2:19][O:32]([O:31]([OH:30])[PH2:33])=[S:34])=[CH2:14])=[CH2:16])[CH3:15]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:L-Alanyl-AmbB metacycM:L-Alanyl-AmbB	L-alanyl-[AmbB non-ribosomal peptide synthase]