input word = C00019825

Metabolite InformationStructural formula
Name Daphneside
Formula C21H26O14
Mw 502.13225554
CAS RN 138771-94-5
C_ID C00019825 ,
InChIKey AWXQCKPVCRTEHJ-KXXRIBQTNA-N
InChICode InChI=1S/C21H26O14/c22-5-9-12(25)14(27)16(29)20(32-9)31-8-3-1-7-2-4-11(24)34-18(7)19(8)35-21-17(30)15(28)13(26)10(6-23)33-21/h1-4,9-10,12-17,20-23,25-30H,5-6H2/t9-,10-,12+,13+,14+,15+,16-,17+,20-,21+/m1/s1
SMILES O=c1ccc2ccc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c2o1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeThymelaeaceaeDaphne arisanensis Ref.
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