input word = C00038178

Metabolite InformationStructural formula
Name 18-Demethylparaensidimerin C
Formula C29H28N2O4
Mw 468.2049074
CAS RN 953393-39-0
C_ID C00038178 ,
InChIKey TWTOZAQFMDPSKK-SZZMBPQTNA-N
InChICode InChI=1S/C29H28N2O4/c1-28(2)23-17(21-24(34-28)15-9-5-7-11-19(15)30-26(21)32)13-29(3)14-18(23)22-25(35-29)16-10-6-8-12-20(16)31(4)27(22)33/h5-12,17-18,23H,13-14H2,1-4H3,(H,30,32)/t17-,18+,23-,29-/m1/s1
SMILES Cn1c(=O)c2c(c3ccccc31)O[C@]1(C)C[C@@H]3c4c(c5ccccc5[nH]c4=O)OC(C)(C)[C@H]3[C@H]2C1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum integrifoliolum Ref.
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