input word = C00018468

Metabolite InformationStructural formula
Name Antibiotic MM 27696
Formula C14H18N2O8S2
Mw 406.05045703
CAS RN 81542-97-4
C_ID C00018468 ,
InChIKey WRYXHINLWZFYBS-JWHGHAPDNA-N
InChICode InChI=1S/C14H18N2O8S2/c1-3-10(17)15-4-5-25-9-6-8-11(7(2)24-26(21,22)23)13(18)16(8)12(9)14(19)20/h4-5,7-8,11H,3,6H2,1-2H3,(H,15,17)(H,19,20)(H,21,22,23)/b5-4+/t7-,8+,11-/m0/s1
SMILES [C@@H]12N(C(=C(C1)S/C=C/NC(=O)CC)C(=O)O)C(=O)[C@H]2[C@H](C)OS(=O)(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces olivaceus CBS 349.80 Ref.
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