input word = C00048278

Metabolite InformationStructural formula
Name 2-O-Demethylkielcorin
(+)-2-O-Demethylkielcorin
Formula C23H18O8
Mw 422.10016755
CAS RN 1197054-69-5
C_ID C00048278 ,
InChIKey YAZWZKNWFXTOQR-MQEFSVKANA-N
InChICode InChI=1S/C23H18O8/c1-28-17-8-11(6-7-14(17)25)20-18(10-24)30-23-21-13(9-15(26)22(23)31-20)19(27)12-4-2-3-5-16(12)29-21/h2-9,18,20,24-26H,10H2,1H3/t18-,20-/m1/s1
SMILES COc1cc([C@H]2Oc3c(O)cc4c(=O)c5ccccc5oc4c3O[C@@H]2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum chinense Ref.
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