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 c12c(cc3c(c1[C@@H](CC(O2)(C)C)c1c2c(c4cc(c5c(c4[nH]2)C=CC(O5)(C)C)C)ccc1)[nH]c1c3cccc1)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya euchrestifolia Ref.
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