input word = C00020722

Metabolite InformationStructural formula
Name 4alpha-Hydroxyguaia-10(14),11(13)-dien-12,6a-olide
Formula C15H20O3
Mw 248.1412445
CAS RN 126621-30-5
C_ID C00020722 ,
InChIKey QRVGCXGOIPXKQE-XOTRIRMANA-N
InChICode InChI=1S/C15H20O3/c1-8-4-5-11-9(2)14(16)18-13(11)12-10(8)6-7-15(12,3)17/h10-13,17H,1-2,4-7H2,3H3/t10-,11-,12-,13-,15+/m0/s1
SMILES C=C1C(=O)O[C@@H]2[C@@H]3[C@@H](CC[C@@]3(C)O)C(=C)CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArctotis auriculata Ref.
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OrganismArctotis auriculata
ReferenceTsichritzis,Phytochem.,29,(1990),195