input word = C00049790

Metabolite InformationStructural formula
Name Forsythenside A
Formula C22H26O10
Mw 450.15259705
CAS RN 202721-09-3
C_ID C00049790 ,
InChIKey KGHHLKGLDXFSCV-ZMPNCUQONA-N
InChICode InChI=1S/C22H26O10/c23-14-3-1-13(2-4-14)11-17(25)31-12-16-18(26)19(27)20(28)21(32-16)30-10-9-22(29)7-5-15(24)6-8-22/h1-8,16,18-21,23,26-29H,9-12H2/t16-,18-,19+,20-,21-/m1/s1
SMILES O=C1C=CC(O)(CCO[C@@H]2O[C@H](COC(=O)Cc3ccc(O)cc3)[C@@H](O)[C@H](O)[C@H]2O)C=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeForsythia suspensa Ref.
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