input word = C00007147

Metabolite InformationStructural formula
Name Schefflerin
Formula C27H32O5
Mw 436.22497413
CAS RN 128718-45-6
C_ID C00007147 ,
InChIKey LCZZAPQMQRPJJJ-CYSOGNJTNA-N
InChICode InChI=1S/C27H32O5/c1-16(2)11-13-19-17(3)12-14-20(18-9-7-6-8-10-18)23(19)25(29)24-21(28)15-22(31-4)27(32-5)26(24)30/h6-12,15,19-20,23,28,30H,13-14H2,1-5H3/t19-,20+,23-/m1/s1
SMILES [C@H]1(C(=O)c2c(cc(c(c2O)OC)OC)O)[C@@H](CC=C([C@H]1CC=C(C)C)C)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeUvaria scheffleri Ref.
zoom in