input word = C00047562

Metabolite InformationStructural formula
Name Scorzodihydrostilbene C
Formula C22H26O9
Mw 434.15768243
CAS RN 1141494-91-8
C_ID C00047562 ,
InChIKey IBJOXGCAQZPNTD-HKNFCHEZNA-N
InChICode InChI=1S/C22H26O9/c1-11(24)18-14(7-4-12-2-5-13(25)6-3-12)15(26)8-9-16(18)30-22-21(29)20(28)19(27)17(10-23)31-22/h2-3,5-6,8-9,17,19-23,25-29H,4,7,10H2,1H3/t17-,19-,20+,21-,22-/m1/s1
SMILES CC(=O)c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc(O)c1CCc1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeScorzonera radiata Ref.
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