input word = C00047437

Metabolite InformationStructural formula
Name Bisdethiobis(methylthio)gliotoxin
Dimethyl gliotoxin
Formula C15H20N2O4S2
Mw 356.0864486
CAS RN 74149-38-5
C_ID C00047437 ,
InChIKey OVBAGMZLGLXSBN-DEZDBRPKNA-N
InChICode InChI=1S/C15H20N2O4S2/c1-16-12(20)14(22-2)7-9-5-4-6-10(19)11(9)17(14)13(21)15(16,8-18)23-3/h4-6,10-11,18-19H,7-8H2,1-3H3/t10-,11-,14+,15+/m0/s1
SMILES CS[C@]1(CO)C(=O)N2[C@H]3C(=CC=C[C@@H]3O)C[C@@]2(SC)C(=O)N1C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaeTalaromyces sp. LGT-2 Ref.
--Isaria tenuipes BCC12625 Ref.
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