input word = C00000538

Metabolite InformationStructural formula
Name Solanapyrone C
Formula C19H25NO4
Mw 331.17835829
CAS RN 88899-59-6
C_ID C00000538 ,
InChIKey FDLXGUBSZCJEGE-HJOPWCEKNA-N
InChICode InChI=1S/C19H25NO4/c1-12-6-7-13-4-2-3-5-14(13)18(12)17-10-16(20-8-9-21)15(11-22)19(23)24-17/h6-7,10-14,18,20-21H,2-5,8-9H2,1H3/t12-,13-,14-,18+/m0/s1
SMILES c1(=O)oc(cc(c1C=O)NCCO)[C@@H]1[C@H](C=C[C@H]2[C@@H]1CCCC2)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
FungiDothideomycetesAlternaria solani Ref.
PlantaeHalimedaceaeHalimeda monile Ref.
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