input word =
C00013118
Metabolite Information
Structural formula
Name
Euonine
Wilformine
(8alpha)-8-(Acetyloxy)-8-deoxoevonimine
Formula
C38H47NO18
Mw
805.27931371
CAS RN
41758-69-4
C_ID
C00013118 ,
InChIKey
QIHHQEWWGMEJTH-UHFFFAOYNA-N
InChICode
InChI=1S/C38H47NO18/c1-17-12-13-25-24(11-10-14-39-25)34(47)50-15-35(8)26-27(51-19(3)41)31(54-22(6)44)37(16-49-18(2)40)32(55-23(7)45)28(52-20(4)42)30(56-33(17)46)36(9,48)38(37,57-35)29(26)53-21(5)43/h10-11,14,17,26-32,48H,12-13,15-16H2,1-9H3/t17-,26+,27-,28-,29-,30+,31-,32+,35+,36-,37-,38-/m0/s1
SMILES
CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1CCC(C)C(=O)OC(C(OC(C)=O)C2OC(C)=O)C4(C)O
Start Substs in Alk. Biosynthesis (Prediction)
L-Asp
L-His
Organism
Kingdom
Family
Species
Reference
Plantae
Celastraceae
Austroplenckia populnea var. ovata
Ref.
Plantae
Celastraceae
Euonymus sieboldiana
Ref.
Plantae
Celastraceae
Maytenus chiapensis
Ref.
Plantae
Celastraceae
Maytenus laevis
Ref.
Plantae
Celastraceae
Tripterygium hypoglaucum Hook.f.
Ref.
Plantae
Celastraceae
Tripterygium wilfordii Hook F.(TwHF)
Ref.
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