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Fe-enterobactin
MNXM7354 is deprecated and here replaced by MNXM730707
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
MNX_ID | MNXM730707 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 9 |
in models (compartimentalized) |
10 |
|
formula | C30H27FeN3O15 |
charge | 0 |
mass | 725.07915 |
reference | biggM:feenter |
InChIKey | IUCUTNMEBZHMGY-LKPURATRSA-H |
InChI | InChI=1S/C30H33N3O15.Fe/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;/h1-9,16-18,28-30,34-39,43-45H,10-12H2,(H,31,40)(H,32,41)(H,33,42);/q;+6/p-6/t16-,17-,18+,28+,29-,30-;/m0./s1 |
SMILES | O=C1N[C@H]2CO[C@@H](O)[C@@H]3CO[C@H](O)[C@@H](CO[C@@H]2O)NC(=O)c2cccc4c2O[Fe]25(Oc6cccc1c6O2)(Oc1cccc(c1O5)C(=O)N3)O4 |
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Parent-child relations graph |
Deprecated MNXref IDs graph |