input word = C00037371

Metabolite InformationStructural formula
Name Khaephuoside A
Formula C20H30O13
Mw 478.16864105
CAS RN 142542-79-8
C_ID C00037371 ,
InChIKey RTNAFZDXHULVPS-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O13/c1-27-10-4-9(5-11(28-2)15(10)29-3)31-18-16(14(24)13(23)12(6-21)32-18)33-19-17(25)20(26,7-22)8-30-19/h4-5,12-14,16-19,21-26H,6-8H2,1-3H3/t12-,13+,14+,16-,17+,18+,19+,20-/m0/s1
SMILES COc1cc(OC2OC(CO)C(O)C(O)C2OC2OCC(O)(CO)C2O)cc(OC)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeBarnettia kerrii Ref.
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