input word = C00027465

Metabolite InformationStructural formula
Name Paliurine E
(-)-Paliurine E
Formula C31H40N4O5
Mw 548.29987042
CAS RN 298184-60-8
C_ID C00027465 ,
InChIKey HNXUZKFGAGMGCX-LRTSFFQCNA-N
InChICode InChI=1S/C31H40N4O5/c1-6-20(2)27-29(36)32-16-14-22-19-23(12-13-25(22)39-5)40-26-15-17-35(28(26)30(37)33-27)31(38)24(34(3)4)18-21-10-8-7-9-11-21/h7-14,16,19-20,24,26-28H,6,15,17-18H2,1-5H3,(H,32,36)(H,33,37)/b16-14+/t20-,24-,26-,27+,28-/m0/s1
SMILES CC[C@H](C)C1NC(=O)[C@@H]2[C@H](CCN2C(=O)[C@H](Cc2ccccc2)N(C)C)Oc2ccc(OC)c(c2)/C=C/NC1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaePaliurus ramosissimus Ref.
PlantaeRhamnaceaePaliurus ramossisimus Ref.
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