input word = C00038521

Metabolite InformationStructural formula
Name Asphodelin A 4'-O-beta-D-glucoside
(+)-Asphodelin A 4'-O-beta-D-glucoside
Formula C21H20O11
Mw 448.10056148
CAS RN 923288-38-4
C_ID C00038521 ,
InChIKey OEZWCAHAQBRTTP-KBSLTFCKNA-N
InChICode InChI=1S/C21H20O11/c22-7-14-17(26)18(27)19(28)21(32-14)30-9-2-4-10(12(24)6-9)15-16(25)11-3-1-8(23)5-13(11)31-20(15)29/h1-6,14,17-19,21-28H,7H2/t14-,17-,18+,19-,21-/m1/s1
SMILES c1(ccc2c(c1)oc(=O)c(c2O)c1c(cc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeAsphodelus microcarpus Ref.
zoom in