Fe-enterochlin
Molecular Formula:
C30H33FeN3O15
InChI: InChI=1/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);/t16-,17-,18+,28+,29-,30-;/m0./s1/f/h31-33H;
InChIKey: InChIKey=WPYKFMKTUGWUGY-HMFQCZHQDV
SMILES: C1C(C(OCC(C(OCC(C(O1)O)NC(=O)C2=C(C(=CC=C2)O)O)O)NC(=O)C3=C(C(=CC=C3)O)O)O)NC(=O)C4=C(C(=CC=C4)O)O.[Fe]
Names:
C06230
Fe-enterobactin
Fe-enterochlin
N-[(2R,3S,6S,7R,10S,11S)-7,11-bis[(2,3-dihydroxybenzoyl)amino]-2,6,10-trihydroxy-1,5,9-trioxacyclododec-3-yl]-2,3-dihydroxy-benzamide; iron
Registries:
PubChem CID 5462308
PubChem ID 8473
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