input word = C00010495

Metabolite InformationStructural formula
Name Asystasioside E
Formula C15H23ClO10
Mw 398.09797467
CAS RN 126005-85-4
C_ID C00010495 ,
InChIKey MQVBIZWHELLSAW-ILYCFTKNNA-N
InChICode InChI=1S/C15H23ClO10/c16-12-8(19)5-1-2-24-13(7(5)15(12,23)4-18)26-14-11(22)10(21)9(20)6(3-17)25-14/h1-2,5-14,17-23H,3-4H2/t5-,6+,7+,8-,9-,10-,11-,12+,13-,14-,15+/m0/s1
SMILES [C@@H]12[C@H]([C@@H](OC=C1)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@@H]1O)O)O)CO)[C@]([C@@H]([C@H]2O)Cl)(O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAsystasia bella Ref.
PlantaePlantaginaceaeVeronica longifolia Ref.
PlantaePlantaginaceaeWulfenia baldaccii Degen Ref.
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