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Aerobactin

MNXM96506 is deprecated and here replaced by MNXM1101937
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1101937Image of MNXM1101937
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 7
formulaC22H33FeN4O13
charge-1
mass617.1399
referencebiggM:arbtn_fe3
InChIKeyVKZKTOZRSOFPMT-UHFFFAOYSA-K
InChIInChI=1S/C22H36N4O13.Fe/c1-13(27)25(38)9-5-3-7-15(19(31)32)23-17(29)11-22(37,21(35)36)12-18(30)24-16(20(33)34)8-4-6-10-26(39)14(2)28;/h15-16,37-39H,3-12H2,1-2H3,(H,23,29)(H,24,30)(H,31,32)(H,33,34)(H,35,36);/q;+2/p-3
SMILESCC(=O)N(O)CCCCC(NC(=O)CC(O)(CC(=O)NC(CCCCN(O)C(C)=O)C(=O)[O-])C(=O)[O-])C(=O)[O-].[Fe+2]
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:arbtn_fe3
biggM:arbtn_fe3 		Aerobactin
biggM:M_arbtn_fe3 secondary/obsolete/fantasy identifier