input word = C00053018

Metabolite InformationStructural formula
Name Epoxyazadiradione
Formula C28H34O6
Mw 466.23553882
CAS RN 18385-59-6
C_ID C00053018
InChIKey NEYCGDYQBQONFC-GGPFZBFUSA-N
InChICode InChI=1S/C28H34O6/c1-15(29)33-20-13-18-24(2,3)19(30)8-10-25(18,4)17-7-11-26(5)21(16-9-12-32-14-16)22(31)23-28(26,34-23)27(17,20)6/h8-10,12,14,17-18,20-21,23H,7,11,13H2,1-6H3/t17-,18+,20-,21-,23-,25-,26+,27+,28-/m1/s1
SMILES [H][C@@]([C@@]1(C)[C@]2([C@]3([H])O2)[C@]4(C)[C@H](OC(C)=O)C[C@@]5([H])C(C)(C)C(C=C[C@]5(C)[C@@]4([H])CC1)=O)(C6=COC=C6)C3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
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