input word = C00018399

Metabolite InformationStructural formula
Name Antibiotic PA 39504X1
Asparenomycin B
Formula C14H18N2O6S
Mw 342.08855705
CAS RN 79366-72-6
C_ID C00018399 ,
InChIKey IATDYGCCUJUVGA-FIQOHUKTNA-N
InChICode InChI=1S/C14H18N2O6S/c1-7(6-17)11-9-5-10(23(22)4-3-15-8(2)18)12(14(20)21)16(9)13(11)19/h9,17H,3-6H2,1-2H3,(H,15,18)(H,20,21)/b11-7+/t9-,23-/m1/s1
SMILES [C@@H]12N(C(=C(C1)[S@](=O)CCNC(=O)C)C(=O)O)C(=O)/C/2=C(/CO)\C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces tokunonensis sp. nov. PA-31088 Ref.
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OrganismStreptomyces tokunonensis sp. nov. PA-31088
ReferenceKawamura,J. Antibiotics,35,(1982),10