input word = C00013123

Metabolite InformationStructural formula
Name O2,O6-Dideacetylevonine
Formula C32H39NO15
Mw 677.23196959
CAS RN 36072-68-1
C_ID C00013123 ,
InChIKey UKUDXSDOMXVGOK-UHFFFAOYNA-N
InChICode InChI=1S/C32H39NO15/c1-13-14(2)27(40)47-24-22(38)26(46-17(5)36)31(12-43-15(3)34)25(45-16(4)35)21(37)19-23(39)32(31,30(24,7)42)48-29(19,6)11-44-28(41)18-9-8-10-33-20(13)18/h8-10,13-14,19,22-26,38-39,42H,11-12H2,1-7H3/t13-,14+,19+,22-,23+,24-,25+,26+,29-,30+,31-,32-/m1/s1
SMILES CC(=O)OCC12C(OC(C)=O)C(=O)C3C(O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(O)C2OC(C)=O)C4(C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeEuonymus europaeus Ref.
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