input word = C00045037

Metabolite InformationStructural formula
Name Puupehenone
(+)-Puupehenone
Formula C21H28O3
Mw 328.20384476
CAS RN 73573-17-8
C_ID C00045037 ,
InChIKey LOCMLXSTDCXZFJ-GWTPHISENA-N
InChICode InChI=1S/C21H28O3/c1-19(2)7-5-8-20(3)17(19)6-9-21(4)18(20)11-13-10-14(22)15(23)12-16(13)24-21/h10-12,17-18,22H,5-9H2,1-4H3/t17-,18+,20-,21-/m0/s1
SMILES C1(=CC2=C[C@H]3[C@@](OC2=CC1=O)(CC[C@@H]1[C@@]3(CCCC1(C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Hyrtios sp. Ref.
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OrganismHyrtios sp.
ReferencePina,J.Nat.Prod.,66,(2003),2