input word = C00009597

Metabolite InformationStructural formula
Name Stemonacetal
Formula C21H20O8
Mw 400.11581762
CAS RN 54357-81-2
C_ID C00009597 ,
InChIKey KLMKGDIYOORAED-UHFFFAOYNA-N
InChICode InChI=1S/C21H20O8/c1-5-27-21-20-17(11-8-14(25-3)15(26-4)9-13(11)29-21)19(23)18-12(22)6-10(24-2)7-16(18)28-20/h6-9,21-22H,5H2,1-4H3/t21-/m1/s1
SMILES c1(cc(c2c(c1)oc1c(c2=O)c2cc(c(cc2O[C@H]1OCC)OC)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeClitoria macrophylla Ref.
PlantaeStemonaceaeStemona collinsae Ref.
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