input word = C00034816

Metabolite InformationStructural formula
Name Carexane L
Formula C21H22O5
Mw 354.14672381
CAS RN 894774-03-9
C_ID C00034816 ,
InChIKey OFASBMPLCKZWQK-UHFFFAOYNA-N
InChICode InChI=1S/C21H22O5/c1-21(2)16-8-6-5-7-13(16)19(22)17(21)11-14-15(20(23)24)9-12(25-3)10-18(14)26-4/h5-10,17H,11H2,1-4H3,(H,23,24)/t17-/m0/s1
SMILES COc1cc(OC)c(CC2C(=O)c3ccccc3C2(C)C)c(C(=O)O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCarex distachya Ref.
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OrganismCarex distachya
ReferenceFiorentino,Phytochem.,67,(2006),971