input word = C00045841

Metabolite InformationStructural formula
Name Dictamnoside A
(-)-Dictamnoside A
Formula C21H36O9
Mw 432.23593275
CAS RN 202278-88-4
C_ID C00045841 ,
InChIKey HYCSHXRCGZLJNW-MRJJJISUNA-N
InChICode InChI=1S/C21H36O9/c1-19(2,27)10-4-7-21-9-28-20(3,6-5-12(21)23)17(21)16(10)30-18-15(26)14(25)13(24)11(8-22)29-18/h10-18,22-27H,4-9H2,1-3H3/t10-,11-,12+,13-,14+,15-,16-,17-,18+,20-,21+/m1/s1
SMILES CC(C)(O)[C@@H]1CC[C@]23CO[C@](C)(CC[C@@H]2O)[C@H]3[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeDictamnus dasycarpus Ref.
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