input word = C00046738

Metabolite InformationStructural formula
Name Excoecarin E
(-)-Excoecarin E
Formula C20H20O2
Mw 292.14632988
CAS RN 183900-31-4
C_ID C00046738 ,
InChIKey VOVNVULYSGPWDO-XTMKFXLTNA-N
InChICode InChI=1S/C20H30O2/c1-17(2)12-6-10-20-11-18(3,15-16(20)22-15)8-5-13(20)19(12,4)9-7-14(17)21/h12-13,15-16H,5-11H2,1-4H3/t12-,13+,15+,16-,18+,19-,20+/m1/s1
SMILES C1C(=O)C([C@@H]2[C@@](C1)([C@H]1[C@@]3(CC2)[C@H]2[C@@H]([C@@](CC1)(C3)C)O2)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeExcoecaria agallocha Ref.
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