input word = C00038712

Metabolite InformationStructural formula
Name Cassythidine
Formula C19H17NO5
Mw 339.11067266
CAS RN 6081-07-8
C_ID C00038712 ,
InChIKey BLQMKAOCFLGRCD-STGVRZAANA-N
InChICode InChI=1S/C19H17NO5/c1-21-17-10-2-3-20-12-4-9-5-13-14(23-7-22-13)6-11(9)16(15(10)12)18-19(17)25-8-24-18/h5-6,12,20H,2-4,7-8H2,1H3/t12-/m0/s1
SMILES c12c(C[C@H]3c4c1c1c(c(c4CCN3)OC)OCO1)cc1c(c2)OCO1
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCassytha filiformis Ref.
zoom in