input word = C00048049

Metabolite InformationStructural formula
Name Pergillin
Formula C15H16O4
Mw 260.104859
CAS RN 74798-20-2
C_ID C00048049 ,
InChIKey MKXDAWJZYZIEIP-GGYSOQFKNA-N
InChICode InChI=1S/C15H16O4/c1-8(2)13-12(16)10-5-4-9-6-15(3,17)18-7-11(9)14(10)19-13/h4-5,17H,6-7H2,1-3H3/t15-/m1/s1
SMILES c12c(ccc3c1OC(=C(C)C)C3=O)C[C@@](OC2)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus ustus 094102 Ref.
PlantaeFabaceaePisum sativum Ref.
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