input word = C00019259

Metabolite InformationStructural formula
Name Licoagroside C
3-Hydroxy-9-methoxycoumestan 3-O-glucoside
Formula C22H20O10
Mw 444.10564686
CAS RN 382137-38-4
C_ID C00019259 ,
InChIKey MCZJEXQGWXOYBF-UKWFNRGSNA-N
InChICode InChI=1S/C22H20O10/c1-28-9-2-4-11-13(6-9)30-20-12-5-3-10(7-14(12)31-21(27)16(11)20)29-22-19(26)18(25)17(24)15(8-23)32-22/h2-7,15,17-19,22-26H,8H2,1H3/t15-,17-,18+,19-,22-/m1/s1
SMILES c1c2c(cc(c1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)oc(=O)c1c2oc2cc(ccc12)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza pallidiflora Ref.
zoom in