input word = C00053366

Metabolite InformationStructural formula
Name Isokaurene
Kaur-15-ene
Formula C20H32
Mw 272.25040102
CAS RN 5947-50-2
C_ID C00053366
InChIKey DQUHDYWUEKWRLN-HPUSYDDDSA-N
InChICode InChI=1S/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h12,15-17H,5-11,13H2,1-4H3/t15-,16-,17+,19-,20-/m1/s1
SMILES CC1=C[C@@]23CC[C@@H]4C(C)(C)CCC[C@@]4(C)[C@@H]2CC[C@@H]1C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeXylopia sericea Ref.
PlantaePoaceaeOryza sativa Ref.
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OrganismXylopia sericea
ReferenceMendes, R. F. et al., J. Pharmacy Pharmacol., 69, (2017), 341-348.