input word = C00023374

Metabolite InformationStructural formula
Name Secoathrixic acid
Formula C20H32O3
Mw 320.23514489
CAS RN 83991-76-8
C_ID C00023374 ,
InChIKey QAUIEDVFBQRSRD-OXVSPPLCNA-N
InChICode InChI=1S/C20H32O3/c1-7-14(2)9-10-16(15(3)21)20(6)12-8-11-19(4,5)17(20)13-18(22)23/h7,9,16-17H,1,8,10-13H2,2-6H3,(H,22,23)/b14-9+/t16-,17-,20+/m1/s1
SMILES C1CC([C@H]([C@@](C1)([C@@H](C(=O)C)C/C=C(\C)/C=C)C)CC(=O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAthrixia elata Ref.
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OrganismAthrixia elata
ReferenceBohlmann,Phytochem.,21,(1982),1806