input word = C00011218

Metabolite InformationStructural formula
Name Pyroclavine
6,8a-Dimethylergoline
Pyroclavin
Formula C16H20N2
Mw 240.16264865
CAS RN 478-89-7
C_ID C00011218 ,
InChIKey VLMZMRDOMOGGFA-SJBIYWEDNA-N
InChICode InChI=1S/C16H20N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-5,8,10,13,15,17H,6-7,9H2,1-2H3/t10-,13+,15+/m0/s1
SMILES c1c2c3c(cc1)[C@@H]1[C@@H](Cc3c[nH]2)N(C[C@H](C1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium commune Ref.
PlantaePoaceaeFestuca rubra Ref.
PlantaePoaceaeTrisetum bifidum Ref.
--Agropyrum semicostatum Ref.
zoom in