input word = C00022577

Metabolite InformationStructural formula
Name 16,17,18,20-Tetrahydroxynerylgeran-1-oic acid lactone
Formula C20H30O5
Mw 350.20932407
CAS RN 129350-01-2
C_ID C00022577 ,
InChIKey WVVUUOIVNGQOMB-HVUPIGRASA-N
InChICode InChI=1S/C20H30O5/c1-16(6-3-9-18-11-20(24)25-15-18)5-2-7-17(12-21)8-4-10-19(13-22)14-23/h6-7,10-11,21-23H,2-5,8-9,12-15H2,1H3/b16-6+,17-7-
SMILES C(=CCC/C(=C/CC/C(=C/CCC1=CC(=O)OC1)/C)/CO)(CO)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePteronia eenii Ref.
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OrganismPteronia eenii
ReferenceZdero,Phytochem.,29,(1990),1231