input word = C00039126

Metabolite InformationStructural formula
Name Epicoccin C
Formula C18H18N2O6S4
Mw 486.00476924
CAS RN 952585-66-9
C_ID C00039126 ,
InChIKey JPUPMIVLDVVGIE-ULIHNHFYNA-N
InChICode InChI=1S/C18H18N2O6S4/c21-7-1-9-13(23)11-5(7)3-17(29-27-9)15(25)20-12-6-4-18(20,16(26)19(11)17)30-28-10(14(12)24)2-8(6)22/h5-6,9-14,23-24H,1-4H2/t5-,6-,9+,10+,11-,12-,13-,14-,17+,18+/m0/s1
SMILES S1S[C@@H]2CC(=O)[C@H]3[C@@H]([C@H]2O)N2[C@@]1(C3)C(=O)N1[C@@H]3[C@H]([C@@H]4SS[C@]1(C[C@H]3C(=O)C4)C2=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Ala L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisEpicoccum nigrum Ref.
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