input word = C00018538

Metabolite InformationStructural formula
Name Bu 2743E
Formula C14H18N2O7
Mw 326.11140095
CAS RN 88167-28-6
C_ID C00018538 ,
InChIKey XVYSGUYPIMZAAK-JFSNLYSUNA-N
InChICode InChI=1S/C14H18N2O7/c1-6(12(20)16-10(7(2)17)14(22)23)15-13(21)8-4-3-5-9(18)11(8)19/h3-7,10,17-19H,1-2H3,(H,15,21)(H,16,20)(H,22,23)/t6-,7+,10-/m0/s1
SMILES C[C@H](NC(=O)c1cccc(O)c1O)C(=O)N[C@H](C(=O)O)[C@@H](C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Asp
Organism
Kingdom Family Species Reference
BacteriaBacillaceaeBacillus circulans No. J725-B93 Ref.
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