input word = C00016146

Metabolite InformationStructural formula
Name Tryprostatin B
(3S-trans)-Hexahydro-3-[[2-(3-methyl-2-butenyl)-1H-indol-3-yl]methyl]-pyrrolo[1,2-a]pyrazine-1,4-dione
Formula C21H25N3O2
Mw 351.19467706
CAS RN 179936-52-8
C_ID C00016146 ,
InChIKey GLWYBXPXOSKQAW-PVIFGLDDNA-N
InChICode InChI=1S/C21H25N3O2/c1-13(2)9-10-17-15(14-6-3-4-7-16(14)22-17)12-18-21(26)24-11-5-8-19(24)20(25)23-18/h3-4,6-7,9,18-19,22H,5,8,10-12H2,1-2H3,(H,23,25)/t18-,19-/m0/s1
SMILES C1CCN2[C@@H]1C(=O)N[C@H](C2=O)Cc1c2c([nH]c1CC=C(C)C)cccc2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus fumigatus Ref.
FungiTrichocomaceaeNeosartorya fischeri Ref.
--Isaria tenuipes BCC12625 Ref.
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