input word = C00019117

Metabolite InformationStructural formula
Name Germanaism B
4'-Hydroxy-5-methoxy-6,7-methylenedioxyisoflavone 4'-O-glucoside
Formula C23H22O11
Mw 474.11621155
CAS RN 123648-56-6
C_ID C00019117 ,
InChIKey MLRDPISQDDYRHC-STEKFDLGNA-N
InChICode InChI=1S/C23H22O11/c1-29-22-16-13(6-14-21(22)32-9-31-14)30-8-12(17(16)25)10-2-4-11(5-3-10)33-23-20(28)19(27)18(26)15(7-24)34-23/h2-6,8,15,18-20,23-24,26-28H,7,9H2,1H3/t15-,18-,19+,20+,23-/m1/s1
SMILES c1(c2c(cc3c1OCO3)occ(c2=O)c1ccc(cc1)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris germanica Ref.
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