input word = C00024722

Metabolite InformationStructural formula
Name Murrafoline C
Formula C36H34N2O2
Mw 526.26202834
CAS RN 98260-37-8
C_ID C00024722 ,
InChIKey CBRHKOUTCCINEW-UHFFFAOYNA-N
InChICode InChI=1S/C36H34N2O2/c1-19-16-26-22-11-9-12-23(30(22)38-31(26)24-14-15-35(3,4)39-33(19)24)27-18-36(5,6)40-34-20(2)17-25-21-10-7-8-13-28(21)37-32(25)29(27)34/h7-17,27,37-38H,18H2,1-6H3/t27-/m0/s1
SMILES Cc1cc2c([nH]c3ccccc32)c2c1OC(C)(C)CC2c1cccc2c1[nH]c1c3c(c(C)cc12)OC(C)(C)C=C3
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya euchrestifolia Ref.
zoom in