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enterobactin

PropertiesImageOccurences in reactions
MNX_IDMNXM883Image of MNXM883
#reac
in my sandbox 0
in MNXref (generic)30
in models (compartimentalized) 16
formulaC30H26N3O15
charge-1
mass668.53866
referencechebi:77805
InChIKeySERBHKJMVBATSJ-BZSNNMDCSA-M
InChIInChI=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
SMILESOc1cccc(C(=O)N[C@H]2COC(=O)[C@H](COC(=O)[C@H](COC2=O)NC(=O)c2cccc(O)c2[O-])NC(=O)c2cccc(O)c2O)c1O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
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
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