input word = C00021239

Metabolite InformationStructural formula
Name Squamulosone
Formula C15H22O
Mw 218.16706532
CAS RN 34413-94-0
C_ID C00021239 ,
InChIKey FUIPJCVSKAWFTI-JXCFRXMANA-N
InChICode InChI=1S/C15H22O/c1-8-5-6-10-9(2)12(16)7-11-14(13(8)10)15(11,3)4/h8,11,13-14H,5-7H2,1-4H3/t8-,11-,13-,14-/m1/s1
SMILES CC1=C2CC[C@@H](C)[C@H]2[C@H]2[C@@H](CC1=O)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcoraceaeAcorus calanus L. Ref.
PlantaeLabiataeHyptis verticillata Ref.
PlantaeRutaceaePhebalium squamulosum Ref.
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