input word = C00020824

Metabolite InformationStructural formula
Name 8alpha-Isovaleryloxyeremanthine
Formula C20H26O4
Mw 330.18310932
CAS RN 77370-09-3
C_ID C00020824 ,
InChIKey HWOMRNIPHMUBHZ-APDXQHIGNA-N
InChICode InChI=1S/C20H26O4/c1-10(2)8-16(21)23-15-9-12(4)14-7-6-11(3)17(14)19-18(15)13(5)20(22)24-19/h9-10,14-15,17-19H,3,5-8H2,1-2,4H3/t14-,15-,17-,18-,19-/m0/s1
SMILES C=C1CC[C@H]2C(C)=C[C@H](OC(=O)CC(C)C)[C@H]3C(=C)C(=O)O[C@@H]3[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentratherum punctatum Ref.
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OrganismCentratherum punctatum
ReferenceBohlmann,Phytochem.,19,(1980),2669