input word = C00021826

Metabolite InformationStructural formula
Name 2-Isocomanone
Formula C15H24O
Mw 220.18271539
CAS RN 103771-84-2
C_ID C00021826 ,
InChIKey QPSMCUKAUIKAPQ-KZUPZXKDNA-N
InChICode InChI=1S/C15H24O/c1-10-6-9-13(3)11(2)12(16)14(4)7-5-8-15(10,13)14/h10-11H,5-9H2,1-4H3/t10-,11-,13+,14+,15+/m0/s1
SMILES C1C[C@]2([C@@]3(C1)[C@@]([C@H](C2=O)C)(CC[C@@H]3C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelichrysum nudifolium Ref.
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