input word = C00002869

Metabolite InformationStructural formula
Name Agrostophyllin
Formula C17H14O4
Mw 282.08920894
CAS RN 116174-99-3
C_ID C00002869 ,
InChIKey JUXGBQIIXCBKIW-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O4/c1-19-11-5-9-3-4-10-6-13(18)17(20-2)12-8-21-14(7-11)16(9)15(10)12/h3-7,18H,8H2,1-2H3
SMILES COc1cc2c3c(ccc4cc(O)c(OC)c(c43)CO2)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeAgrostophyllum brevipes Ref.
PlantaeOrchidaceaeAgrostophyllum khasiyanum Ref.
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