input word = C00062741

Metabolite InformationStructural formula
Name 1,3,5-Trimethyladamantane
Formula C13H22
Mw 178.1721507
CAS RN 707-35-7
C_ID C00062741
InChIKey WCACLGXPFTYVEL-UHFFFAOYSA-N
InChICode InChI=1S/C13H22/c1-11-4-10-5-12(2,7-11)9-13(3,6-10)8-11/h10H,4-9H2,1-3H3
SMILES CC12CC3CC(C)(C1)CC(C)(C3)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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