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 c1(CCc2c(ccc(c2C(=O)C)O[C@@H]2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)CO)O)ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeScorzonera radiata Ref.
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