input word = C00008401

Metabolite InformationStructural formula
Name Pinocembrin 7-[4-(1-hydroxyethyl)phenyl] ether
Formula C23H20O5
Mw 376.13107375
CAS RN 108544-83-8
C_ID C00008401 ,
InChIKey YCOTUQMQORMKOG-UHFFFAOYNA-N
InChICode InChI=1S/C23H20O5/c1-14(24)15-7-9-17(10-8-15)27-18-11-19(25)23-20(26)13-21(28-22(23)12-18)16-5-3-2-4-6-16/h2-12,14,21,24-25H,13H2,1H3/t14-,21-/m0/s1
SMILES c1c(c2c(cc1Oc1ccc(cc1)[C@H](C)O)O[C@@H](CC2=O)c1ccccc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelichrysum stirlingii Ref.
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