input word = C00046133

Metabolite InformationStructural formula
Name Merrillianone
(+)-Merrillianone
Formula C15H22O5
Mw 282.14672381
CAS RN 259529-86-7
C_ID C00046133 ,
InChIKey ABPRNZFKAHLYNW-LRIGQPDNNA-N
InChICode InChI=1S/C15H22O5/c1-8-4-5-9-12(2)7-19-11-10(16)14(8,9)6-15(18,20-11)13(12,3)17/h5,8,10-11,16-18H,4,6-7H2,1-3H3/t8-,10+,11+,12+,13-,14-,15-/m1/s1
SMILES [C@H]1([C@]23C[C@]4(O[C@@H]1OC[C@@](C3=CC[C@H]2C)([C@@]4(C)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium merrillianum Ref.
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OrganismIllicium merrillianum
ReferenceHuang,J.Nat.Prod.,64,(2001),428