input word = C00026656

Metabolite InformationStructural formula
Name Dichotomide I
Formula C18H17N3O4
Mw 339.12190605
CAS RN 755036-54-5
C_ID C00026656 ,
InChIKey VALNLVQKQKEOLC-UHFFFAOYSA-N
InChICode InChI=1S/C18H17N3O4/c1-10(22)16-17-12(11-5-3-4-6-13(11)20-17)9-14(21-16)18(24)19-8-7-15(23)25-2/h3-6,9,20H,7-8H2,1-2H3,(H,19,24)
SMILES c12c(c3c([nH]1)c(nc(c3)C(=O)NCCC(=O)OC)C(=O)C)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeStellaria dichotoma Ref.
PlantaeCaryophyllaceaeStellaria dichotoma L.var. lanceolata Ref.
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OrganismStellaria dichotoma L.var. lanceolata
ReferenceMorikawa,Chem.Pharm.Bull.,52,(2004),1194