input word = C00013125

Metabolite InformationStructural formula
Name Evonoline
4-Deoxyevonine
Formula C36H43NO16
Mw 745.25818434
CAS RN 36017-50-2
C_ID C00013125 ,
InChIKey HIZXOIDYACHULC-UHFFFAOYNA-N
InChICode InChI=1S/C36H43NO16/c1-15-16(2)32(44)52-27-17(3)36-29(49-20(6)40)24(34(9,53-36)13-47-33(45)23-11-10-12-37-25(15)23)26(43)30(50-21(7)41)35(36,14-46-18(4)38)31(51-22(8)42)28(27)48-19(5)39/h10-12,15-17,24,27-31H,13-14H2,1-9H3/t15-,16-,17+,24-,27+,28-,29-,30-,31+,34-,35-,36-/m1/s1
SMILES CC(=O)OCC12C(OC(C)=O)C(=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeEuonymus europaeus Ref.
zoom in