input word = C00036191

Metabolite InformationStructural formula
Name Pectinolide C
Formula C14H20O5
Mw 268.13107375
CAS RN 149155-56-6
C_ID C00036191 ,
InChIKey DYWKRIWLCNEWRY-VGZHJBCSNA-N
InChICode InChI=1S/C14H20O5/c1-3-4-5-11(18-10(2)15)6-8-13-12(16)7-9-14(17)19-13/h6-9,11-13,16H,3-5H2,1-2H3/b8-6-/t11-,12-,13-/m0/s1
SMILES CCCC[C@@H](/C=C[C@@H]1OC(=O)C=C[C@@H]1O)OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeHyptis pectinata Ref.
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OrganismHyptis pectinata
ReferenceBoalino,Phytochem.,64,(2003),1303