input word = C00019283

Metabolite InformationStructural formula
Name Ferrichrome
Formula C27H42FeN9O12
Mw 740.23023467
CAS RN 15630-64-5
C_ID C00019283 ,
InChIKey GGUNGDGGXMHBMJ-UHFFFAOYNA-N
InChICode InChI=1S/C27H42N9O12.Fe/c1-16(37)34(46)10-4-7-19-25(43)30-14-23(41)28-13-22(40)29-15-24(42)31-20(8-5-11-35(47)17(2)38)26(44)33-21(27(45)32-19)9-6-12-36(48)18(3)39;/h19-21H,4-15H2,1-3H3,(H,28,41)(H,29,40)(H,30,43)(H,31,42)(H,32,45)(H,33,44);/q-3;+3/t19-,20+,21+;/m1./s1
SMILES N12C(=[O][Fe+3]345([O-]1)[O]=C(N([O-]3)CCC[C@H]1C(=O)N[C@@H](CCCN(C(=[O]4)C)[O-]5)C(=O)N[C@H](CCC2)C(=O)NCC(=O)NCC(=O)NCC(=O)N1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaEnterobacteriaceaeEscherichia coli Ref.
FungiTrichocomaceaeAspergillus fumigatus Ref.
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