input word = C00039217

Metabolite InformationStructural formula
Name Flexusine B
(-)-Flexusine B
Formula C20H30O2
Mw 302.2245802
CAS RN 1033722-55-2
C_ID C00039217 ,
InChIKey XYGZKBQEGUFULA-STMTZMBSNA-N
InChICode InChI=1S/C20H30O2/c1-14(2)17-13-19-20(5,22-19)11-7-10-15(3)8-6-9-16(4)12-18(17)21/h9-10,13-14,19H,6-8,11-12H2,1-5H3/b15-10+,16-9+,17-13-/t19-,20-/m0/s1
SMILES C/C1=CCC[C@]2(C)O[C@H]2/C=C(/C(C)C)C(=O)C/C(C)=C/CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSarcophyton flexuosum Ref.
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