input word = C00037595

Metabolite InformationStructural formula
Name Paliurine H
(-)-Paliurine H
Formula C33H51N5O6
Mw 613.3839344
CAS RN 403842-57-9
C_ID C00037595 ,
InChIKey XVZRBFRCIURJSU-WRIKIBMVNA-N
InChICode InChI=1S/C33H51N5O6/c1-9-19(4)26(34-7)31(40)37-28(21(6)11-3)33(42)38-17-15-25-29(38)32(41)36-27(20(5)10-2)30(39)35-16-14-22-18-23(44-25)12-13-24(22)43-8/h12-14,16,18-21,25-29,34H,9-11,15,17H2,1-8H3,(H,35,39)(H,36,41)(H,37,40)/b16-14+/t19-,20-,21-,25+,26+,27+,28+,29+/m1/s1
SMILES C1(=O)[C@@H]2[C@@H](Oc3cc(/C=C/NC(=O)[C@@H](N1)[C@@H](CC)C)c(cc3)OC)CCN2C(=O)[C@@H](NC(=O)[C@@H](NC)[C@@H](CC)C)[C@@H](CC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaePaliurus ramossisimus Ref.
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