input word = C00021877

Metabolite InformationStructural formula
Name Rotundene
Formula C15H24
Mw 204.18780077
CAS RN 65128-08-7
C_ID C00021877 ,
InChIKey XAAMMPKFMNZIIC-UHFFFAOYNA-N
InChICode InChI=1S/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h9-10,12-14H,4-8H2,1-3H3/t10-,12+,13-,14-,15+/m1/s1
SMILES CC1=CC2(C)CCC1CC1C(C)CCC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeRhaponticum carthamoides Ref.
PlantaeCyperaceaeCyperus alopecuroides Ref.
PlantaeCyperaceaeCyperus rotundus Ref.
PlantaeCyperaceaeCyperus scariosus Ref.
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OrganismCyperus scariosus
ReferenceNerali,Indian J. Chem.,8,(1970),854