input word = C00034811

Metabolite InformationStructural formula
Name Carexane E
(+)-Carexane E
Formula C20H20O4
Mw 324.13615913
CAS RN 885480-29-5
C_ID C00034811 ,
InChIKey WQFABVWRBLAEQK-AQPSWHTGNA-N
InChICode InChI=1S/C20H20O4/c1-20(2)13-7-5-4-6-10(13)16-14(20)8-11-12(17(16)21)9-15(24-3)19(23)18(11)22/h4-7,9,14,16,22-23H,8H2,1-3H3/t14-,16+/m1/s1
SMILES c12c(C[C@@H]3[C@@H](C1=O)c1c(C3(C)C)cccc1)c(c(c(c2)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCarex distachya Ref.
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