input word = C00051776

Metabolite InformationStructural formula
Name Paspalic acid
Formula C16H16N2O2
Mw 268.12117777
CAS RN 5516-88-1
C_ID C00051776
InChIKey
InChICode InChI=1S/C16H16N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-5,7,12,14,17H,6,8H2,1H3,(H,19,20)/t12-,14-/m1/s1
SMILES C1(=C[C@H]2[C@H](N(C1)C)Cc1c3c2cccc3[nH]c1)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiClavicipitaceaeClaviceps paspali Ref.
FungiClavicipitaceaeClaviceps purpurea 20.1 Ref.
FungiClavicipitaceaeEpichloe festucae Fl1 Ref.
FungiClavicipitaceaeEpichloe inebrians e818 Ref.
--Bakabsua obtecta B249 Ref.
--Neotyphodium gansuense Ref.
--Periglandula ipomoeae lasaF13 Ref.
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