input word = C00011274

Metabolite InformationStructural formula
Name 12,13-Dihydroprolyl-2-(1',1'-dimethylallyltryptophyl) diketopiperazine
Formula C21H23N3O2
Mw 349.179027
CAS RN
C_ID C00011274 ,
InChIKey JYWYHBYADQANKH-XISACWJONA-N
InChICode InChI=1S/C21H23N3O2/c1-4-21(2,3)18-14(13-8-5-6-9-15(13)22-18)12-16-20(26)24-11-7-10-17(24)19(25)23-16/h4-6,8-10,16,22H,1,7,11-12H2,2-3H3,(H,23,25)/t16-/m0/s1
SMILES c1c2c(ccc1)c(c([nH]2)C(C)(C)C=C)C[C@@H]1NC(=O)C2=CCCN2C1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate Secologanin
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus ustus Ref.
FungiTrichocomaceaePenicillium italicum Ref.
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OrganismAspergillus ustus
ReferenceCole,Handbook of Secondary Fungal Metabolites,Volume I,(2003)

Steyn,Tetrahedron,29,(1973),107