input word = C00021391

Metabolite InformationStructural formula
Name Carotdiol acetate
Formula C17H28O3
Mw 280.20384476
CAS RN 122769-22-6
C_ID C00021391 ,
InChIKey WNPRWXZHNMYWHE-FDQDZQOGNA-N
InChICode InChI=1S/C17H28O3/c1-11(2)14-7-9-16(5)8-6-12(3)15(20-13(4)18)10-17(14,16)19/h6,11,14-15,19H,7-10H2,1-5H3/t14-,15-,16+,17+/m1/s1
SMILES CC(=O)O[C@@H]1C[C@]2(O)[C@@H](C(C)C)CC[C@]2(C)CC=C1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula linkii Ref.
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