input word = C00028135

Metabolite InformationStructural formula
Name Dehatrine
Formula C37H38N2O6
Mw 606.27298696
CAS RN 19634-27-6
C_ID C00028135 ,
InChIKey LPFIPRSEXCVWTR-KSTXGFNDNA-N
InChICode InChI=1S/C37H38N2O6/c1-39-15-13-25-20-34(42-4)36(43-5)37-35(25)29(39)17-23-8-11-30(40-2)32(18-23)44-26-9-6-22(7-10-26)16-28-27-21-33(45-37)31(41-3)19-24(27)12-14-38-28/h6-11,18-21,29H,12-17H2,1-5H3/t29-/m1/s1
SMILES COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)cc3c1[C@@H](C2)N(C)CC3
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeLauraceaeBeilschmiedia madang BL. Ref.
PlantaeLauraceaeDehaasia triandra Ref.
--Beilshmiedia madana Ref.
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