input word = C00001717

Metabolite InformationStructural formula
Name Elymoclavine
Formula C16H18N2O
Mw 254.14191321
CAS RN 548-43-6
C_ID C00001717 ,
InChIKey DAVNRFCJMIONPO-DDOUFSBJNA-N
InChICode InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,13,15,17,19H,6,8-9H2,1H3/t13-,15-/m1/s1
SMILES C1(=C[C@H]2[C@H](N(C1)C)Cc1c3c2cccc3[nH]c1)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiClavicipitaceaeClaviceps paspali Ref.
FungiClavicipitaceaeClaviceps purpurea Ref.
FungiClavicipitaceaeClaviceps sp. SD58 Ref.
FungiClavicipitaceaeEpichloe festucae Fl1 Ref.
FungiClavicipitaceaeEpichloe inebrians e818 Ref.
FungiTrichocomaceaeAspergillus fumigatus Ref.
PlantaeConvolvulaceaeArgyreia nervosa Ref.
PlantaeConvolvulaceaeIpomoea corymbosa Ref.
PlantaePoaceaeElymus mollis Ref.
PlantaePoaceaePennisetum typhoideum Ref.
--Bakabsua obtecta B249 Ref.
--Neotyphodium gansuense Ref.
--Periglandula ipomoeae lasaF13 Ref.
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