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

enterobactin

Properties Image Occurences in reactions MNX_ID MNXM883 #reac in my sandbox 0 in MNXref (generic) 32 in models (compartimentalized) 17 formula C30H26N3O15 charge -1 mass 668.544 reference chebi:77805 InChIKey SERBHKJMVBATSJ-BZSNNMDCSA-M InChI InChI=1S/C30H27N3O15/c34-19-7-1-4-13(22(19)37)25(40)31-16-10-46-29(44)18(33-27(42)15-6-3-9-21(36)24(15)39)12-48-30(45)17(11-47-28(16)43)32-26(41)14-5-2-8-20(35)23(14)38/h1-9,16-18,34-39H,10-12H2,(H,31,40)(H,32,41)(H,33,42)/p-1/t16-,17-,18-/m0/s1 SMILES [cH:1]1[cH:4][c:13]([C:25](=[N:31][C@H:16]2[CH2:10][O:46][C:29](=[O:44])[C@@H:18]([N:33]=[C:27]([c:15]3[cH:6][cH:3][cH:9][c:21]([OH:36])[c:24]3[OH:39])[OH:42])[CH2:12][O:48][C:30](=[O:45])[C@@H:17]([N:32]=[C:26]([c:14]3[cH:5][cH:2][cH:8][c:20]([OH:35])[c:23]3[OH:38])[OH:41])[CH2:11][O:47][C:28]2=[O:43])[OH:40])[c:22]([OH:37])[c:19]([OH:34])[cH:7]1

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:77805 chebi:77805	enterobactin 2-({(3S,7S,11S)-7,11-bis[(2,3-dihydroxybenzoyl)amino]-2,6,10-trioxo-1,5,9-trioxacyclododecan-3-yl}carbamoyl)-6-hydroxyphenolate enterobactin(1-)
hmdb:HMDB0032199	Chymosin preparation, escherichia coli k-12 (3S-(3R*,7R*,11R*))-N,n',n''-(2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl)tris(2,3-dihydroxybenzamide) Enterobactin Enterochelin H6ENT N-[(3S,7S,11S)-7,11-bis(2,3-dihydroxybenzamido)-2,6,10-trioxo-1,5,9-trioxacyclododecan-3-yl]-2,3-dihydroxybenzamide Tri-(2,3-dihydroxy-N-benzoyl-L-serine)-ester Tri-(N-(2,3-dihydroxybenzoyl)-L-serine)-ester enterobactin
seed.compound:cpd03453 seedM:cpd03453	Enterobactin Enterochelin Tri-(2,3-dihydroxy-N-benzoyl-L-serine)-ester Tri-(N-(2,3-dihydroxybenzoyl)-L-serine)-ester enter enterobactin
bigg.metabolite:enter biggM:enter	Enterochelin
sabiork.compound:8179 sabiorkM:8179 kegg.compound:C05821 keggC:C05821	Enterochelin Enterobactin Tri-(2,3-dihydroxy-N-benzoyl-L-serine)-ester Tri-(N-(2,3-dihydroxybenzoyl)-L-serine)-ester
CHEBI:38150 chebi:38150	enterobactin(6-) 3,3',3''-{[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris(iminocarbonyl)}tribenzene-1,2-diolate ent(6-)
metacyc.compound:ENTEROBACTIN metacycM:ENTEROBACTIN	enterobactin (2,3-dihydroxybenzoylserine)3 N-(2,3-dihydroxybenzoyl)-O-[N-(2,3-dihydroxybenzoyl)-O-[N-(2,3-dihydroxybenzoyl)-L-seryl]-L-seryl]-L-serine-(3->1(3))-lactone enterochelin
reactome:R-ALL-1222366 reactomeM:R-ALL-1222366 CHEBI:28855 chebi:28855	enterobactin (3S-(3R*,7R*,11R*))-N,N',N''-(2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl)tris(2,3-dihydroxybenzamide) Enterobactin Enterochelin H6ent N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris(2,3-dihydroxybenzamide) Tri-(2,3-dihydroxy-N-benzoyl-L-serine)-ester Tri-(N-(2,3-dihydroxybenzoyl)-L-serine)-ester
hmdb:HMDB32199 chebi:23923 chebi:4799 biggM:M_enter keggC:M_C05821 seedM:M_cpd03453	secondary/obsolete/fantasy identifier