input word = C00047168

Metabolite InformationStructural formula
Name Alstiphyllanine D
(-)-Alstiphyllanine D
Formula C33H38N2O9
Mw 606.25773083
CAS RN 1124378-39-7
C_ID C00047168 ,
InChIKey JZXJPTVFORSZEN-NORVQKDYNA-N
InChICode InChI=1S/C33H38N2O9/c1-8-17-15-35-25-14-21(17)32(31(37)42-7,16-43-30(36)18-11-23(39-4)28(41-6)24(12-18)40-5)27-26-20-13-19(38-3)9-10-22(20)34(2)33(25,26)44-29(27)35/h8-13,21,25-27,29H,14-16H2,1-7H3/b17-8-/t21-,25-,26+,27+,29-,32+,33-/m0/s1
SMILES C/C=C1/CN2[C@H]3C[C@@H]1C(COC(=O)c1cc(OC)c(OC)c(OC)c1)(C(=O)OC)[C@@H]1C4c5cc(OC)ccc5N(C)[C@@]43O[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia macrophylla Ref.
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OrganismAlstonia macrophylla
ReferenceHirasawa,J.Nat.Prod.,72,(2009),304