input word = C00003152

Metabolite InformationStructural formula
Name Ipomoeamarone
(+)-Ngaione
Formula C15H22O3
Mw 250.15689457
CAS RN 494-23-5
C_ID C00003152 ,
InChIKey WOFDWNOSFDVCDF-PVRQQBJHNA-N
InChICode InChI=1S/C15H22O3/c1-11(2)8-13(16)9-15(3)6-4-14(18-15)12-5-7-17-10-12/h5,7,10-11,14H,4,6,8-9H2,1-3H3/t14-,15+/m1/s1
SMILES C1C[C@@H](O[C@@]1(CC(=O)CC(C)C)C)c1cocc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaeIpomoea batatas Ref.
PlantaeMyoporaceaeMyoporum deserti A.Cunn. Ref.
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