input word = C00015907

Metabolite InformationStructural formula
Name Pyochelin
Pyochelin I
Pyocheline
Formula C14H16N2O3S2
Mw 324.06023385
CAS RN 79236-62-7
C_ID C00015907 ,
InChIKey NYBZAGXTZXPYND-YXYSCNJNNA-N
InChICode InChI=1S/C14H16N2O3S2/c1-16-10(14(18)19)7-21-13(16)9-6-20-12(15-9)8-4-2-3-5-11(8)17/h2-5,9-10,13,17H,6-7H2,1H3,(H,18,19)/t9-,10+,13-/m1/s1
SMILES c1cc(c(cc1)C1=N[C@H](CS1)[C@@H]1N([C@@H](CS1)C(=O)O)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp
Organism
Kingdom Family Species Reference
BacteriaPseudomonadaceaePseudomonas akbaalia 8(C)X Ref.
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