input word = C00050990

Metabolite InformationStructural formula
Name Isorhyncophylline
Formula C22H28N2O4
Mw 384.2049074
CAS RN 6859-01-4
C_ID C00050990
InChIKey DAXYUDFNWXHGBE-QOOZKHRFNA-N
InChICode InChI=1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22-/m0/s1
SMILES CC[C@H]1CN2CC[C@@]3(C(=O)Nc4ccccc43)[C@@H]2CC1/C(=COC)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeUncaria macrophylla Ref.
PlantaeRubiaceaeUncaria rhynchophyllus Ref.
PlantaeRubiaceaeUncaria sinensis Ref.
zoom in