input word = C00014402

Metabolite InformationStructural formula
Name Hypnum acid methyl ester
3,5,7,4'-Tetrahydroxyflavanone 3'-(4-hydroxybenzoic acid methyl ester)
Formula C23H18O9
Mw 438.09508217
CAS RN 156024-79-2
C_ID C00014402 ,
InChIKey AVHQURNAYUXRLX-UHFFFAOYNA-N
InChICode InChI=1S/C23H18O9/c1-31-23(30)11-3-5-16(26)14(7-11)13-6-10(2-4-15(13)25)22-21(29)20(28)19-17(27)8-12(24)9-18(19)32-22/h2-9,21-22,24-27,29H,1H3/t21-,22+/m1/s1
SMILES COC(=O)c1ccc(O)c(-c2cc(C3Oc4cc(O)cc(O)c4C(=O)C3O)ccc2O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypnaceaeHypnum cupressiforme Ref.
zoom in



OrganismHypnum cupressiforme
ReferenceSievers,Phytochem.,35,(1994),795