input word = C00024690

Metabolite InformationStructural formula
Name Bismurrayafoline C
Formula C46H52N2O4
Mw 696.39270816
CAS RN 139726-48-0
C_ID C00024690 ,
InChIKey BFHBTRZNNJZPLB-DPCVLPDWSA-N
InChICode InChI=1S/C46H52N2O4/c1-25(2)11-9-13-27(5)15-17-33-37(49)21-19-31-35-23-29(7)39(45(51)43(35)47-41(31)33)40-30(8)24-36-32-20-22-38(50)34(42(32)48-44(36)46(40)52)18-16-28(6)14-10-12-26(3)4/h11-12,15-16,19-24,47-52H,9-10,13-14,17-18H2,1-8H3/b27-15+,28-16+
SMILES CC(C)=CCC/C(C)=C/Cc1c(O)ccc2c1[nH]c1c(O)c(-c3c(C)cc4c([nH]c5c(C/C=C(C)CCC=C(C)C)c(O)ccc54)c3O)c(C)cc12
Start Substs in Alk. Biosynthesis (Prediction) L-Pro Anthranilate L-Lys
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya euchrestifolia Ref.
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