input word = C00036601

Metabolite InformationStructural formula
Name 5-O-Demethylpaxanthonin
Formula C23H23NO6
Mw 409.15253747
CAS RN 689286-73-5
C_ID C00036601 ,
InChIKey NIUFEZJKXNOMNB-VEZULTJBNA-N
InChICode InChI=1S/C23H23NO6/c1-10(2)11-7-13(23(3,4)9-11)17-15(25)8-16-18(21(17)28)19(26)12-5-6-14(24-29)20(27)22(12)30-16/h5-6,8,11,13,25,27-28H,1,7,9H2,2-4H3/t11-,13+/m0/s1
SMILES c12c(oc3c(c1=O)c(c(c(c3)O)[C@@H]1C(C[C@H](C1)C(=C)C)(C)C)O)c(c(cc2)N=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum patulum Ref.
PlantaeHypericaceaeHypericum roeperanum Ref.
PlantaeHypericaceaeHypericum styphelioides Ref.
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OrganismHypericum patulum
ReferencePeres,Phytochem.,55,(2000),683