input word = C00029305

Metabolite InformationStructural formula
Name (+)-Methyl abscisate
Formula C16H22O4
Mw 278.15180919
CAS RN 60102-39-8
C_ID C00029305 ,
InChIKey HHDYPZVHXGPCRG-MCCDFFCYNA-N
InChICode InChI=1S/C16H22O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-9,19H,10H2,1-5H3/b7-6+,11-8-/t16-/m1/s1
SMILES C1=C([C@@](C(CC1=O)(C)C)(/C=C/C(=C\C(=O)OC)/C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLigularia dentata Hara Ref.
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OrganismLigularia dentata Hara
ReferenceBaba,J.Nat.Med.,61,(2007),472