input word = C00010493

Metabolite InformationStructural formula
Name Asystasioside A
Formula C22H34O14
Mw 522.1948558
CAS RN 126005-81-0
C_ID C00010493 ,
InChIKey CUSICZFUZAPHLA-SKLIONQVNA-N
InChICode InChI=1S/C22H34O14/c1-7-2-3-8-9(19(31)35-21-17(29)15(27)13(25)10(4-23)33-21)6-32-20(12(7)8)36-22-18(30)16(28)14(26)11(5-24)34-22/h6-8,10-18,20-30H,2-5H2,1H3/t7-,8-,10-,11+,12-,13-,14-,15+,16+,17+,18+,20+,21+,22?/m1/s1
SMILES C[C@@H]1CC[C@@H]2C(C(=O)O[C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)=CO[C@@H](O[C@@H]3OC(CO)[C@@H](O)C(O)[C@@H]3O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAsystasia bella Ref.
zoom in